Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 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 | |
|---|---|---|---|---|
| SCHEMBL11522401 | 0.85 | KCNH2 (0.36) | — | |
| SCHEMBL10287016 | 0.81 | ACHE (0.38) | CXCR4 | |
| SCHEMBL4073537 | 0.81 | ACHE (0.35) | CXCR4 | |
| SCHEMBL23425947 | 0.78 | CHRNB2 (0.43) | CXCR4 | |
| SCHEMBL23504188 | 0.78 | CHRNB2 (0.43) | CXCR4 | |
| SCHEMBL11520415 | 0.78 | CXCR4 (0.32) | CXCR4 | |
| SCHEMBL10286300 | 0.76 | ACHE (0.35) | — | |
| SCHEMBL11459025 | 0.75 | PARP1 (0.31) | — | |
| SCHEMBL11522209 | 0.74 | TRPV1 (0.32) | — | |
| SCHEMBL19151680 | 0.73 | MTNR1A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4160094-A | Tetrahydroquinoline derivatives | JOHN WYETH & BROTHER LIMITED (GB) | 1979-07-03 | — | — | US | claimed |
| US-4160094-A | Tetrahydroquinoline derivatives | JOHN WYETH & BROTHER LIMITED (GB) | 1979-07-03 | — | — | US | disclosed |