Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 10/20 | 0.59 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | CXCR3 | P49682 | 3/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | MGAT2 | Q10469 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11075680 | 0.80 | CYP19A1 (0.64) | CYP19A1CXCR3 | |
| SCHEMBL12313146 | 0.80 | CYP19A1 (0.64) | CYP19A1CXCR3 | |
| SCHEMBL11911732 | 0.80 | CYP19A1 (0.64) | CYP19A1CXCR3 | |
| SCHEMBL14520901 | 0.79 | CYP19A1 (0.72) | CYP19A1CXCR3 | |
| SCHEMBL4556388 | 0.79 | CYP19A1 (0.72) | CYP19A1CXCR3 | |
| SCHEMBL8245665 | 0.74 | CYP19A1 (0.70) | CYP19A1CXCR3 | |
| SCHEMBL10530941 | 0.74 | CYP19A1 (1.00) | CYP19A1 | |
| SCHEMBL22623727 | 0.74 | CYP19A1 (1.00) | CYP19A1 | |
| SCHEMBL10530071 | 0.74 | CYP19A1 (1.00) | CYP19A1 | |
| SCHEMBL13201868 | 0.74 | CYP19A1 (0.70) | CYP19A1CXCR3 |
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-4435419-A | Method of treating depression using azabicyclohexanes | AMERICAN CYANAMID COMPANY (US) | 1984-03-06 | — | — | US | disclosed |
| US-4231935-A | ANXIOLYTICS AND ANALGESICS | AMERICAN CYANAMID COMPANY (US) | 1980-11-04 | — | — | US | disclosed |
| US-4196120-A | 1,2-BIS(HYDROCARBYLSULFONYLOXY OR HALO METHYL)CYCLOPROPYLBENZENE, OPTICAL ACITIVITY ANALGESICS | AMERICAN CYANAMID COMPANY (US) | 1980-04-01 | — | — | US | disclosed |
| US-4131611-A | ANXIOLYTIC, ANALGESIC | AMERICAN CYANAMID COMPANY (US) | 1978-12-26 | — | — | US | disclosed |