Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 2/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Thiobenzoic Acid SCHEMBL2396148 | 0.91 | TSHR (0.52) | CA2CA1CA12CA3CA6 | |
| Thiobenzoic Acid SCHEMBL7572809 | 0.84 | ALDH1A1 (0.52) | CA2CA1TSHRALDH1A1CYP2A6 | |
| Thiobenzoic Acid SCHEMBL28362422 | 0.83 | TSHR (0.43) | CA2CA1CA12CA3CA6 | |
| Thiobenzoic Acid SCHEMBL28371585 | 0.83 | KMT2A (0.44) | CA2CA1TSHRGSK3BALDH1A1 | |
| SCHEMBL2369004 | 0.78 | CA2 (0.50) | CA2CA1CA12CA3CA6 | |
| SCHEMBL16527195 | 0.78 | CA2 (0.50) | CA2CA1CA12CA3CA6 | |
| SCHEMBL28879880 | 0.78 | CA2 (0.50) | CA2CA1CA12CA3CA6 | |
| SCHEMBL7532498 | 0.78 | CA2 (0.50) | CA2CA1CA12CA3CA6 | |
| SCHEMBL7205889 | 0.78 | CA2 (0.50) | CA2CA1CA12CA3CA6 | |
| SCHEMBL2396144 | 0.78 | CA2 (0.54) | CA2CA1CA12CA3CA6 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114839366-A | Nanoparticle for detecting antigen protein and preparation method thereof | 南方科技大学 | 2022-08-02 | — | — | CN | claimed |
| US-4252814-A | ANTIFERTILITY AGENTS, INSECTICIDES | AMERICAN CYANAMID COMPANY (US) | 1981-02-24 | — | — | US | claimed |
| CN-114839366-A | Nanoparticle for detecting antigen protein and preparation method thereof | 南方科技大学 | 2022-08-02 | — | — | CN | disclosed |
| US-5204482-A | Ethylenediamine monoamide heteroaryl derivatives | HOFFMAN-LAROCHE INC. (US) | 1993-04-20 | — | — | US | disclosed |
| US-5011849-A | Monoamine oxidase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 1991-04-30 | — | — | US | disclosed |
| EP-0212404-A1 | 7-oxo-4-thia-1-azabicyclo [3.2.0] hept-2-ene derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-03-04 | — | — | EP | disclosed |