Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.52 |
| ▸ | TACR1 | P25103 | 9/20 | 0.49 |
| ▸ | TACR2 | P21452 | 6/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9028425 | 1.00 | CCR5 (0.52) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL9027461 | 0.98 | CCR5 (0.54) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL9028598 | 0.98 | CCR5 (0.54) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL9027473 | 0.98 | CCR5 (0.54) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL8884647 | 0.96 | TACR2 (0.53) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL8884820 | 0.96 | TACR2 (0.53) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL8884639 | 0.96 | TACR2 (0.53) | CCR5TACR1TACR2MCHR1 | |
| SCHEMBL9028653 | 0.94 | CCR5 (0.48) | CCR5TACR1TACR2 | |
| SCHEMBL9027464 | 0.94 | CCR5 (0.48) | CCR5TACR1TACR2 | |
| SCHEMBL9027909 | 0.92 | CCR5 (0.51) | CCR5TACR1TACR2 |
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-5563133-A | NERVOUS SYSTEM DISORDERS | ELI LILLY AND COMPANY (US) | 1996-10-08 | — | — | US | disclosed |
| EP-0714891-A1 | Heterocyclic tachykinin receptor antagonists | ELI LILLY AND COMPANY (US) | 1996-06-05 | — | — | EP | disclosed |