Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 8/20 | 0.77 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.77 |
| ▸ | CA1 | P00915 | 1/20 | 0.77 |
| ▸ | CA2 | P00918 | 1/20 | 0.77 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.77 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.77 |
| ▸ | ITGAL | P20701 | 1/20 | 0.77 |
| ▸ | CA4 | P22748 | 1/20 | 0.77 |
| ▸ | CA6 | P23280 | 1/20 | 0.77 |
| ▸ | ADK | P55263 | 1/20 | 0.77 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | AXL | P30530 | 1/20 | 0.43 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Indole SCHEMBL69715 | 0.91 | AHR (0.71) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL31131470 | 0.91 | AHR (0.71) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL28690779 | 0.91 | AHR (0.71) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL27909376 | 0.91 | AHR (0.71) | AHRTRPA1CA1CA2ITGB2 | |
| Naphthalene SCHEMBL28144510 | 0.90 | AHR (0.68) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL28299852 | 0.90 | AHR (0.68) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL28342343 | 0.90 | AHR (0.68) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL7026553 | 0.88 | AHR (0.90) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL6702023 | 0.88 | AHR (0.90) | AHRTRPA1CA1CA2ITGB2 | |
| Indole SCHEMBL30250492 | 0.88 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483555-B | Pyrazine indole terminal receptor-based D (Pi-A)2Small molecular donor material, preparation method and application | 常州大学 | 2021-07-30 | — | — | CN | claimed |
| CN-110483555-A | D (π-A) of the one kind based on pyrazine indoles end receptor2Type small molecule donor material and preparation method and application | UNIV CHANGZHOU | 2019-11-22 | — | — | CN | claimed |
| CN-1064359-C | Diindole heterocyclic compounds, preparing method and use thereof | SHANGHAI INST ORGANIC CHEM (CN) | 2001-04-11 | — | — | CN | claimed |
| CN-1224015-A | Diindole heterocyclic compounds, preparing method and use thereof | SHANGHAI INST ORGANIC CHEM (CN) | 1999-07-28 | — | — | CN | claimed |
| CN-110483555-B | Pyrazine indole terminal receptor-based D (Pi-A)2Small molecular donor material, preparation method and application | 常州大学 | 2021-07-30 | — | — | CN | disclosed |
| CN-110483555-B | Pyrazine indole terminal receptor-based D (Pi-A)2Small molecular donor material, preparation method and application | 常州大学 | 2021-07-30 | — | — | CN | disclosed |
| CN-110483555-B | Pyrazine indole terminal receptor-based D (Pi-A)2Small molecular donor material, preparation method and application | 常州大学 | 2021-07-30 | — | — | CN | disclosed |
| CN-110483555-A | D (π-A) of the one kind based on pyrazine indoles end receptor2Type small molecule donor material and preparation method and application | UNIV CHANGZHOU | 2019-11-22 | — | — | CN | disclosed |
| CN-110483555-A | D (π-A) of the one kind based on pyrazine indoles end receptor2Type small molecule donor material and preparation method and application | UNIV CHANGZHOU | 2019-11-22 | — | — | CN | disclosed |
| CN-110483555-A | D (π-A) of the one kind based on pyrazine indoles end receptor2Type small molecule donor material and preparation method and application | UNIV CHANGZHOU | 2019-11-22 | — | — | CN | disclosed |
| CN-1064359-C | Diindole heterocyclic compounds, preparing method and use thereof | SHANGHAI INST ORGANIC CHEM (CN) | 2001-04-11 | — | — | CN | disclosed |
| CN-1224015-A | Diindole heterocyclic compounds, preparing method and use thereof | SHANGHAI INST ORGANIC CHEM (CN) | 1999-07-28 | — | — | CN | disclosed |