Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 13/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 11/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.42 |
| ▸ | KCNA3 | P22001 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5570412 | 0.85 | P2RY1 (0.46) | — | |
| SCHEMBL5566711 | 0.82 | MAPT (0.44) | CYP2D6 | |
| SCHEMBL5566695 | 0.78 | KMT2A (0.43) | — | |
| SCHEMBL5570603 | 0.77 | F10 (0.40) | OPRK1CYP2D6OPRM1OPRD1 | |
| SCHEMBL5570595 | 0.77 | F10 (0.40) | OPRK1CYP2D6OPRM1OPRD1 | |
| SCHEMBL5566744 | 0.77 | ROCK2 (0.44) | — | |
| SCHEMBL5569499 | 0.76 | TNIK (0.35) | OPRK1CYP2D6OPRM1OPRD1 | |
| SCHEMBL5567013 | 0.76 | LMNA (0.46) | — | |
| SCHEMBL5569345 | 0.75 | OPRM1 (0.46) | OPRM1 | |
| SCHEMBL5570796 | 0.75 | P2RY1 (0.46) | — |
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 |