Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22075884 | 0.62 | TSHR (0.35) | TSHR | |
| SCHEMBL775567 | 0.60 | CYP1A2 (0.58) | CA2 | |
| SCHEMBL10963241 | 0.59 | SIGMAR1 (0.56) | CA2 | |
| SCHEMBL8082718 | 0.59 | SIGMAR1 (0.56) | CA2 | |
| SCHEMBL2792349 | 0.59 | SIGMAR1 (0.56) | CA2 | |
| SCHEMBL770351 | 0.58 | CYP1A2 (0.52) | CA2 | |
| SCHEMBL769824 | 0.58 | CYP1A2 (0.52) | CA2 | |
| SCHEMBL19062021 | 0.57 | KCNH2 (0.51) | CA2 | |
| SCHEMBL12040727 | 0.57 | CYP1A2 (0.53) | CA2 | |
| SCHEMBL577806 | 0.57 | CYP1A2 (0.76) | CA2TSHR |
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-6355665-B1 | ANTIHISTAMINES, ANTIALLERGENS AND IRRITABLE BOWEL SYNDROME. | JAMES BLACK FOUNDATION LIMITED (GB) | 2002-03-12 | — | — | US | disclosed |