Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.42 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.42 |
| ▸ | ITGAL | P20701 | 3/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL6506666 | 1.00 | OPRM1 (0.53) | OPRM1OPRK1POLBNPC1RAB9A | |
| SCHEMBL6505746 | 0.85 | NPC1 (0.44) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6505741 | 0.85 | NPC1 (0.44) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6506032 | 0.84 | POLB (0.49) | POLBNPC1RAB9AITGALITGB2 | |
| SCHEMBL6506038 | 0.84 | POLB (0.49) | POLBNPC1RAB9AITGALITGB2 | |
| SCHEMBL6504799 | 0.80 | SMN1; SMN2 (0.51) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6504800 | 0.80 | SMN1; SMN2 (0.51) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6496828 | 0.79 | KDM4E (0.48) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6502814 | 0.79 | NPC1 (0.46) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL | |
| SCHEMBL6496819 | 0.79 | KDM4E (0.48) | NPC1RAB9AAPOBEC3AAPOBEC3GITGAL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |