Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 12/20 | 0.51 |
| ▸ | HTR2A | P28223 | 5/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.42 |
| ▸ | HRH1 | P35367 | 4/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.42 |
| ▸ | DRD3 | P35462 | 4/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.42 |
| ▸ | HTR6 | P50406 | 4/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.42 |
| ▸ | CACNA1C | Q13936 | 4/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | MTOR | P42345 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11074234 | 0.90 | CYP19A1 (0.51) | CYP19A1DRD3DRD2MEN1LMNA | |
| SCHEMBL8969269 | 0.75 | CYP19A1 (0.62) | CYP19A1MAPK1MEN1USP2MAPT | |
| SCHEMBL7430028 | 0.72 | ALDH1A1 (0.64) | CYP2D6RAB9ACYP1A2MAPTCYP2C19 | |
| SCHEMBL8968925 | 0.72 | CYP19A1 (0.82) | CYP19A1MEN1KMT2ASMN1; SMN2TSHR | |
| SCHEMBL11081758 | 0.70 | CYP19A1 (0.76) | CYP19A1LMNACYP1A2GAACYP2C9 | |
| SCHEMBL6002297 | 0.69 | CYP19A1 (0.72) | CYP19A1CYP3A4NPSR1GAAALDH1A1 | |
| SCHEMBL11078445 | 0.68 | CYP19A1 (0.71) | CYP19A1CYP2C19SMN1; SMN2TSHRALDH1A1 | |
| SCHEMBL10529975 | 0.68 | CYP19A1 (1.00) | CYP19A1 | |
| Fumaric Acid SCHEMBL11077742 | 0.68 | DRD3 (0.45) | HTR2AADRA1AHRH1OPRM1DRD3 | |
| Fumaric Acid SCHEMBL11077747 | 0.68 | DRD3 (0.45) | HTR2AADRA1AHRH1OPRM1DRD3 |
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 |