Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.51 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | CPN1 | P15169 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | ACP1 | P24666 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | EED | O75530 | 3/20 | 0.36 |
| ▸ | NPY1R | P25929 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7704486 | 0.93 | HRH3 (0.53) | HRH3NAAAHRH4KMT2ACPN1 | |
| SCHEMBL28741956 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL19578854 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL12557625 | 0.90 | NAAA (0.48) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL7593657 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL8948236 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL6198775 | 0.90 | HRH3 (0.45) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL4303428 | 0.90 | NAAA (0.48) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL22857512 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 | |
| SCHEMBL19286087 | 0.90 | CYP1A2 (0.47) | HRH3NAAAHRH4KMT2ASIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4391812-A | ANTIINFLAMMATORY AGENTS | MERCK & CO., INC. (US) | 1983-07-05 | — | — | US | disclosed |
| US-4342872-A | ANTIMICROBIAL AGENTS | MERCK & CO., INC. (US) | 1982-08-03 | — | — | US | disclosed |
| US-4342873-A | MICROBIOCIDES | MERCK & CO., INC. (US) | 1982-08-03 | — | — | US | disclosed |
| US-4247700-A | MICROBIOCIDES | MERCK & CO., INC. (US) | 1981-01-27 | — | — | US | disclosed |