Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 4/20 | 0.43 |
| ▸ | THRB | P10828 | 4/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | NPY2R | P49146 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7163250 | 1.00 | ALDH1A1 (0.47) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL7164257 | 0.99 | ALDH1A1 (0.48) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL7161998 | 0.94 | LMNA (0.49) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL7168103 | 0.90 | ALDH1A1 (0.50) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL1981552 | 0.83 | HPGD (0.52) | ALDH1A1LMNAMAPTS1PR1S1PR3 | |
| SCHEMBL14195850 | 0.81 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL3955227 | 0.80 | THRA (0.57) | ALDH1A1LMNAMAPTTHRATHRB | |
| SCHEMBL9218172 | 0.80 | FFAR1 (0.43) | ALDH1A1LMNATHRATHRBS1PR1 | |
| SCHEMBL7163248 | 0.80 | FFAR1 (0.43) | ALDH1A1LMNATHRATHRBS1PR1 | |
| SCHEMBL8408121 | 0.79 | THRA (0.49) | THRATHRBFFAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0269859-B2 | Pyrazolotriazine compounds | OTSUKA PHARMA CO LTD (JP) | 1995-10-18 | — | — | EP | disclosed |
| US-4824834-A | TREATING GOUT | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1989-04-25 | — | — | US | disclosed |
| EP-0269859-A2 | Pyrazolotriazine compounds | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1988-06-08 | — | — | EP | disclosed |