Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.59 |
| ▸ | HRH1 | P35367 | 6/20 | 0.58 |
| ▸ | HTR2A | P28223 | 6/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7199600 | 0.98 | SIGMAR1 (0.57) | SIGMAR1HRH1HTR2ACYP19A1TAAR1 | |
| SCHEMBL904449 | 0.93 | HRH1 (0.60) | SIGMAR1HRH1HTR2ACYP19A1TAAR1 | |
| SCHEMBL9073997 | 0.87 | HRH1 (0.71) | SIGMAR1HRH1HTR2ACYP19A1TAAR1 | |
| SCHEMBL2172475 | 0.82 | HRH1 (0.56) | SIGMAR1HRH1HTR2ATAAR1EPHX2 | |
| SCHEMBL7808300 | 0.80 | CYP19A1 (0.46) | SIGMAR1CYP19A1EPHX2KCNH2 | |
| SCHEMBL8995497 | 0.80 | TSHR (0.41) | SIGMAR1HRH1HTR2ACYP19A1TAAR1 | |
| SCHEMBL30171026 | 0.80 | HRH1 (0.54) | SIGMAR1HRH1HTR2ATAAR1EPHX2 | |
| SCHEMBL6902789 | 0.79 | CYP19A1 (0.45) | SIGMAR1CYP19A1KCNH2 | |
| SCHEMBL4590208 | 0.79 | SIGMAR1 (0.39) | SIGMAR1HRH1HTR2A | |
| SCHEMBL5089274 | 0.79 | CYP19A1 (0.45) | SIGMAR1CYP19A1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1042291-A1 | ARYL-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS | Klinge Pharma GmbH (DE) | 2000-10-11 | — | — | EP | disclosed |
| WO-1999031064-A1 | ARYL-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS | KLINGE PHARMA GMBH (DE) | 1999-06-24 | — | — | WO | disclosed |