Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR6 | O00574 | 7/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13490618 | 0.88 | MEN1 (0.54) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| SCHEMBL13490372 | 0.88 | MEN1 (0.54) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| SCHEMBL13490741 | 0.88 | MEN1 (0.54) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| SCHEMBL14192268 | 0.88 | MEN1 (0.54) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3213396 | 0.87 | CXCR6 (0.53) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL3218463 | 0.87 | CXCR6 (0.53) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A | |
| SCHEMBL14192836 | 0.86 | CHEK1 (0.46) | CXCR6HTR2BSMN1; SMN2 | |
| SCHEMBL13490393 | 0.86 | CXCR6 (0.53) | CXCR6SMN1; SMN2NPC1TP53RAB9A | |
| Hydrochloric Acid SCHEMBL3224377 | 0.85 | CXCR6 (0.52) | CXCR6SMN1; SMN2NPC1TP53RAB9A | |
| SCHEMBL13490400 | 0.85 | HTR2B (0.56) | CXCR6HTR2BSMN1; SMN2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008075196-A1 | BENZIMIDAZOLE DERIVATIVES | PFIZER PRODUCTS INC. (US) | 2008-06-26 | — | — | WO | disclosed |