Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 2/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11262405 | 0.86 | TDO2 (0.48) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11256693 | 0.86 | ALDH1A1 (0.39) | TDO2IDO1KMT2ANPSR1GAA | |
| SCHEMBL11253962 | 0.82 | TDO2 (0.45) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11248931 | 0.81 | TDO2 (0.44) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11255704 | 0.80 | PTGDR2 (0.49) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11248945 | 0.79 | IDO1 (0.42) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11500393 | 0.78 | PTGDR2 (0.45) | TDO2IDO1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL11258335 | 0.77 | ALDH1A1 (0.39) | TDO2IDO1KMT2ANPSR1GAA | |
| SCHEMBL11260499 | 0.76 | TDO2 (0.50) | TDO2IDO1PDE3BPDE3AKMT2A | |
| SCHEMBL11266566 | 0.76 | KDR (0.40) | TDO2IDO1PDE3BPDE3AKMT2A |
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-4337256-A | ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS | TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) | 1982-06-29 | — | — | US | disclosed |
| EP-0013411-A1 | Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 1980-07-23 | — | — | EP | disclosed |