Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.41 |
| ▸ | EBP | Q15125 | 2/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8315432 | 0.94 | OPRM1 (0.48) | CYP2D6CYP2C9KMT2AMEN1DRD3 | |
| SCHEMBL8316856 | 0.79 | OPRM1 (0.52) | DRD3DRD2SIGMAR1HTR1AHTR2A | |
| SCHEMBL8312626 | 0.78 | DRD4 (0.47) | KMT2ADRD2DRD4SIGMAR1ALDH1A1 | |
| SCHEMBL8315004 | 0.78 | OPRD1 (0.47) | — | |
| SCHEMBL8313011 | 0.78 | DRD2 (0.45) | CYP2D6CYP2C9KMT2AMEN1DRD3 | |
| SCHEMBL10557192 | 0.78 | DRD3 (0.51) | DRD3DRD2SMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL10462690 | 0.78 | KMT2A (0.49) | KMT2AMEN1DRD3DRD2DRD4 | |
| SCHEMBL27508978 | 0.77 | OPRM1 (0.45) | KMT2AMEN1DRD3DRD2DRD4 | |
| SCHEMBL10559361 | 0.76 | KMT2A (0.57) | KMT2AMEN1DRD3DRD2DRD4 | |
| SCHEMBL10460413 | 0.76 | KDM4E (0.50) | KMT2AMEN1DRD3DRD2DRD4 |
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-0536419-B1 | TRICYCLIC TRIAZOLE DERIVATIVES, PRODUCTION AND USE THEREOF | TORAY INDUSTRIES (JP) | 1999-10-13 | — | — | EP | disclosed |
| US-5683998-A | ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, ANTIPAF AGENTS | TORAY INDUSTRIES, INC. (JP) | 1997-11-04 | — | — | US | disclosed |