Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 2/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.39 |
| ▸ | GLS | O94925 | 2/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5569213 | 0.95 | SLC6A4 (0.52) | OPRM1OPRL1SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL5570728 | 0.89 | ALDH1A1 (0.41) | ROCK2ROCK1BAZ1APOLBTAAR1 | |
| SCHEMBL5567514 | 0.88 | EPHX2 (0.48) | ROCK2ROCK1BAZ1APOLBTAAR1 | |
| SCHEMBL5570796 | 0.83 | P2RY1 (0.46) | ROCK2ROCK1BAZ1APOLBTAAR1 | |
| SCHEMBL5566744 | 0.83 | ROCK2 (0.44) | ROCK2ROCK1BAZ1APOLBTAAR1 | |
| SCHEMBL5566995 | 0.83 | OPRM1 (0.51) | OPRM1OPRL1ROCK2ROCK1BAZ1A | |
| SCHEMBL5570412 | 0.80 | P2RY1 (0.46) | ROCK2ROCK1BAZ1APOLBCNR1 | |
| SCHEMBL5570567 | 0.79 | CNR1 (0.52) | SLC6A4SLC6A3SLC6A2CNR1 | |
| SCHEMBL5570477 | 0.78 | POLB (0.49) | ROCK2ROCK1BAZ1APOLBTAAR1 | |
| SCHEMBL5570394 | 0.78 | ROCK2 (0.45) | OPRM1OPRL1ROCK2ROCK1BAZ1A |
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-7250415-B2 | 1,1-Disubstitutedcycloalkyl-, glycinamidyl-, sulfonyl-amidino-, and tetrahydropyrimidinyl-containing diaminoalkyl, β-aminoacids, α-aminoacids and derivatives thereof as factor Xa inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-07-31 | — | — | US | disclosed |