Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 5/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 5/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 4/20 | 0.38 |
| ▸ | HTR2B | P41595 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9729933 | 0.87 | PNMT (0.38) | PNMTCTSDHTR2CSRD5A1HTR2A | |
| SCHEMBL9491648 | 0.81 | PNMT (0.46) | PNMTCTSDHTR2CHTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL9729718 | 0.79 | PNMT (0.45) | PNMTCTSDSRD5A1 | |
| SCHEMBL25026112 | 0.78 | PNMT (0.41) | PNMTCTSDHTR2CSRD5A1HTR2A | |
| SCHEMBL30233671 | 0.78 | PNMT (0.41) | PNMTCTSDHTR2CSRD5A1HTR2A | |
| SCHEMBL9729442 | 0.77 | CYP11B1 (0.43) | PNMTHTR2CSRD5A1HTR2AHTR2B | |
| SCHEMBL2837191 | 0.75 | GRIN2B (0.50) | — | |
| SCHEMBL9729768 | 0.75 | DRD2 (0.39) | — | |
| SCHEMBL16867892 | 0.74 | KCNH2 (0.46) | PNMTHTR2CHTR2AHTR2B | |
| SCHEMBL31757570 | 0.74 | KCNH2 (0.46) | PNMTHTR2CHTR2AHTR2B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5079245-A | 2-trifluoromethyl-7-substitute-6,7,8,9-tetrahydro-[5H]-benzocycloheptenes | ADIR ET COMPAGNIE (FR) | 1992-01-07 | — | — | US | disclosed |