Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.51 |
| ▸ | HRH1 | P35367 | 5/20 | 0.48 |
| ▸ | HTR2A | P28223 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL318816 | 0.94 | CYP19A1 (0.47) | CYP19A1HRH1HTR2AKMT2AMEN1 | |
| SCHEMBL7331536 | 0.88 | CYP19A1 (0.46) | CYP19A1KMT2AMEN1SCN5ASLC6A3 | |
| SCHEMBL5635206 | 0.88 | HRH1 (0.60) | CYP19A1HRH1HTR2ALMNASIGMAR1 | |
| SCHEMBL11800229 | 0.82 | CYP19A1 (0.51) | CYP19A1HRH1HTR2ASCN5ASLC6A3 | |
| SCHEMBL7382843 | 0.81 | CYP19A1 (0.44) | CYP19A1KMT2AMEN1MITFALDH1A1 | |
| SCHEMBL21855514 | 0.81 | CYP19A1 (0.51) | CYP19A1HRH1HTR2AKMT2AMEN1 | |
| SCHEMBL7810718 | 0.80 | TBXAS1 (0.53) | CYP19A1LMNAHTTSLC6A3 | |
| SCHEMBL7322903 | 0.79 | CYP19A1 (0.48) | CYP19A1HRH1HTR2A | |
| SCHEMBL6577383 | 0.76 | AOC3 (0.47) | KMT2AMEN1LMNASIGMAR1DRD3 | |
| SCHEMBL6578930 | 0.76 | AOC3 (0.47) | KMT2AMEN1LMNASIGMAR1DRD3 |
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-3989707-A | NEUROLEPTIC AGENTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1976-11-02 | — | — | US | disclosed |
| US-3960961-A | 4'-Fluoro-4-{[4-(phenyl)cyclohexyl]amino}butyrophenones and the salts thereof | THE UPJOHN COMPANY (US) | 1976-06-01 | — | — | US | disclosed |