Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 6/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9123944 | 0.88 | TAAR1 (0.58) | TAAR1KDM4EATMHTR2AHTR2C | |
| SCHEMBL3480270 | 0.81 | MAOA (0.47) | TAAR1 | |
| SCHEMBL10663751 | 0.81 | POLB (0.49) | ATMHTR2A | |
| SCHEMBL8587828 | 0.78 | TAAR1 (0.53) | TAAR1HTR2AHTR2CADRA1ACYP1A2 | |
| SCHEMBL8586269 | 0.78 | MTNR1A (0.61) | TAAR1HTR2AHTR2CADRA1ACYP1A2 | |
| SCHEMBL5547193 | 0.73 | MAOA (0.41) | KDM4E | |
| SCHEMBL5547192 | 0.73 | MAOA (0.41) | — | |
| SCHEMBL9751556 | 0.71 | CA2 (0.56) | TAAR1HTR2ACYP1A2 | |
| SCHEMBL8586513 | 0.71 | TAAR1 (0.53) | TAAR1KDM4EATMHTR2AADRA1A | |
| SCHEMBL73404 | 0.71 | TAAR1 (0.53) | TAAR1HTR2AADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998027984-A1 | METHOD OF PRODUCING ANALGESIA BY ADMINISTRATION OF 1,2,3,4-TETRAHYDROBENZO-[b]THIENO[2,3-c]PYRIDINE AND DERIVATIVES | NEUREX CORPORATION (US) | 1998-07-02 | — | — | WO | disclosed |
| US-4971974-A | ANOREXIGENIC AGENTS, BENZO B!THIENO 2,3-C!PYRIDINE COMPOUNDS | NEUREX CORPORATION (US) | 1990-11-20 | — | — | US | disclosed |