Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.55 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.55 |
| ▸ | ITGAL | P20701 | 1/20 | 0.55 |
| ▸ | CA4 | P22748 | 1/20 | 0.55 |
| ▸ | CA6 | P23280 | 1/20 | 0.55 |
| ▸ | AHR | P35869 | 1/20 | 0.55 |
| ▸ | ADK | P55263 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 12/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 12/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 11/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
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 SCHEMBL28765097 | 0.90 | AHR (0.55) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL27909376 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL4075709 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL28690779 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL7643909 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL69715 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL31131470 | 0.88 | AHR (0.71) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL28342343 | 0.86 | AHR (0.68) | TRPA1CA1CA2ITGB2ICAM1 | |
| Indole SCHEMBL28299852 | 0.86 | AHR (0.68) | TRPA1CA1CA2ITGB2ICAM1 | |
| Naphthalene SCHEMBL28144510 | 0.86 | AHR (0.68) | TRPA1CA1CA2ITGB2ICAM1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106632329-B | The indole derivatives and its synthetic method of a kind of pyridine piperidines indoles and ring structure | 南阳师范学院 | 2018-09-18 | — | — | CN | claimed |
| CN-106632329-A | Indole derivative with pyridine-piperidine-indole ring structure and synthesis method of indole derivative | 南阳师范学院 | 2017-05-10 | — | — | CN | claimed |
| CN-106632329-B | The indole derivatives and its synthetic method of a kind of pyridine piperidines indoles and ring structure | 南阳师范学院 | 2018-09-18 | — | — | CN | disclosed |
| CN-106632329-B | The indole derivatives and its synthetic method of a kind of pyridine piperidines indoles and ring structure | 南阳师范学院 | 2018-09-18 | — | — | CN | disclosed |
| CN-106632329-B | The indole derivatives and its synthetic method of a kind of pyridine piperidines indoles and ring structure | 南阳师范学院 | 2018-09-18 | — | — | CN | disclosed |
| CN-106632329-A | Indole derivative with pyridine-piperidine-indole ring structure and synthesis method of indole derivative | 南阳师范学院 | 2017-05-10 | — | — | CN | disclosed |
| CN-106632329-A | Indole derivative with pyridine-piperidine-indole ring structure and synthesis method of indole derivative | 南阳师范学院 | 2017-05-10 | — | — | CN | disclosed |
| CN-106632329-A | Indole derivative with pyridine-piperidine-indole ring structure and synthesis method of indole derivative | 南阳师范学院 | 2017-05-10 | — | — | CN | disclosed |