Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | PLA2G1B | P04054 | 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 | |
|---|---|---|---|---|
| SCHEMBL6659623 | 0.92 | CYP1A2 (0.42) | CYP1A2CYP2C9CYP2C19NPY2RRAB9A | |
| SCHEMBL6660613 | 0.85 | NPY2R (0.35) | CYP1A2CYP2C9CYP2C19NPY2RKMT2A | |
| SCHEMBL6659012 | 0.85 | NPY2R (0.35) | CYP1A2CYP2C9CYP2C19NPY2RKMT2A | |
| SCHEMBL6660877 | 0.82 | NPSR1 (0.35) | RAB9AKEAP1NFE2L2ALDH1A1GAA | |
| SCHEMBL6666837 | 0.79 | RAB9A (0.36) | NPY2RRAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL3868793 | 0.77 | CYP2C9 (0.43) | CYP1A2CYP2C9CYP2C19NPY2RRAB9A | |
| SCHEMBL6664426 | 0.77 | ALDH1A1 (0.33) | KMT2AMEN1KDM4EALDH1A1NPSR1 | |
| SCHEMBL6631941 | 0.77 | NPY2R (0.39) | CYP1A2CYP2C9CYP2C19NPY2RKMT2A | |
| SCHEMBL5850602 | 0.77 | CYP1A2 (0.45) | CYP1A2CYP2C9CYP2C19NPY2RRAB9A | |
| SCHEMBL3869878 | 0.76 | CYP1A2 (0.41) | CYP1A2CYP2C9CYP2C19NPY2RRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1000051-B1 | CARBAMYLOXY COMPOUNDS WHICH INHIBIT LEUKOCYTE ADHESION MEDIATED BY VLA-4 | ELAN PHARM INC (US) | 2004-05-19 | — | — | EP | claimed |