Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | F7 | P08709 | 6/20 | 0.31 |
| ▸ | F3 | P13726 | 6/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | KLK1 | P06870 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2912239 | 0.99 | SLC6A3 (0.35) | SLC6A3ALKCA1CA2CA4 | |
| Hydrochloric Acid SCHEMBL2525623 | 0.85 | KMT2A (0.35) | SLC6A3ALKCA1CA2CA7 | |
| SCHEMBL13613444 | 0.84 | CDK1 (0.40) | ALKF7F3 | |
| SCHEMBL13613477 | 0.84 | CDK1 (0.40) | ALKF7F3 | |
| SCHEMBL11348081 | 0.84 | F7 (0.43) | F7F3 | |
| SCHEMBL13613521 | 0.84 | F7 (0.43) | F7F3 | |
| SCHEMBL13613443 | 0.84 | CDK1 (0.40) | ALKF7F3 | |
| SCHEMBL13613511 | 0.84 | CDK7 (0.37) | SLC6A3ALKLMNACYP3A4CYP1A2 | |
| SCHEMBL13613512 | 0.84 | CDK7 (0.37) | SLC6A3ALKLMNACYP3A4CYP1A2 | |
| SCHEMBL13613427 | 0.84 | CDK7 (0.37) | SLC6A3ALKLMNACYP3A4CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7622585-B2 | Phenylglycinamide derivatives useful as anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-24 | — | — | US | disclosed |