Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 16/20 | 0.54 |
| ▸ | TACR3 | P29371 | 3/20 | 0.51 |
| ▸ | TACR2 | P21452 | 2/20 | 0.51 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.50 |
| ▸ | CCR5 | P51681 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8807882 | 0.88 | TACR3 (0.52) | TACR1TACR3TACR2CCR5 | |
| SCHEMBL8062670 | 0.88 | NPY5R (0.51) | TACR1TACR3TACR2NPY5RCCR5 | |
| SCHEMBL8062667 | 0.88 | NPY5R (0.51) | TACR1TACR3TACR2NPY5RCCR5 | |
| SCHEMBL3856787 | 0.82 | TACR3 (0.49) | TACR1TACR3TACR2CCR5 | |
| SCHEMBL8069588 | 0.82 | TACR2 (0.66) | TACR1TACR2 | |
| SCHEMBL8069589 | 0.82 | TACR2 (0.66) | TACR1TACR2 | |
| SCHEMBL9118639 | 0.81 | TACR3 (0.54) | TACR1TACR3TACR2CCR5 | |
| SCHEMBL8802198 | 0.79 | TACR3 (0.53) | TACR1TACR3TACR2CCR5 | |
| SCHEMBL8062838 | 0.79 | TACR2 (0.58) | TACR1TACR2CCR5 | |
| SCHEMBL8062836 | 0.79 | TACR2 (0.58) | TACR1TACR2CCR5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995028931-A1 | SPIRO-SUBSTITUTED AZACYCLES AS NEUROKININ-3 ANTAGONISTS | MERCK & CO., INC. (US) | 1995-11-02 | — | — | WO | claimed |
| US-5434158-A | Asthma | MERCK & CO., INC. (US) | 1995-07-18 | — | — | US | claimed |
| EP-0758238-A4 | SPIRO-SUBSTITUTED AZACYCLES AS NEUROKININ-3 ANTAGONISTS | MERCK & CO INC (US) | 1997-09-03 | — | — | EP | disclosed |
| EP-0758238-A1 | SPIRO-SUBSTITUTED AZACYCLES AS NEUROKININ-3 ANTAGONISTS | MERCK & CO. INC. (US) | 1997-02-19 | — | — | EP | disclosed |
| WO-1995028931-A1 | SPIRO-SUBSTITUTED AZACYCLES AS NEUROKININ-3 ANTAGONISTS | MERCK & CO., INC. (US) | 1995-11-02 | — | — | WO | disclosed |
| US-5434158-A | Asthma | MERCK & CO., INC. (US) | 1995-07-18 | — | — | US | disclosed |