Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 14/20 | 0.58 |
| ▸ | TACR1 | P25103 | 13/20 | 0.58 |
| ▸ | TACR3 | P29371 | 4/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6948617 | 0.97 | TACR2 (0.59) | TACR2TACR1TACR3HRH1HTT | |
| SCHEMBL8810091 | 0.94 | TACR2 (0.65) | TACR2TACR1TACR3HRH1 | |
| SCHEMBL8886812 | 0.94 | TACR2 (0.65) | TACR2TACR1TACR3HRH1 | |
| SCHEMBL9027948 | 0.91 | TACR2 (0.49) | TACR2TACR1HTTCYP3A4CYP2C9 | |
| SCHEMBL9028251 | 0.90 | TACR2 (0.57) | TACR2TACR1TACR3HRH1HTT | |
| SCHEMBL9027885 | 0.87 | TACR2 (0.58) | TACR2TACR1TACR3HRH1 | |
| SCHEMBL9027870 | 0.86 | TACR2 (0.56) | TACR2TACR1TACR3HRH1 | |
| SCHEMBL6956796 | 0.86 | TACR2 (0.63) | TACR2TACR1TACR3HRH1HTT | |
| SCHEMBL8883701 | 0.85 | TACR2 (0.55) | TACR2TACR1TACR3HRH1HTT | |
| SCHEMBL9027802 | 0.85 | TACR2 (0.59) | TACR2TACR1TACR3HRH1CYP3A4 |
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 |