Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6775456 | 0.80 | TSHR (0.48) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL25460932 | 0.80 | HTR2A (0.57) | TSHRHTR2AHTR2CHTR2BMEN1 | |
| SCHEMBL7496340 | 0.77 | HTR2A (0.53) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL25460925 | 0.76 | HTR2A (0.61) | HTR2AHTR2CHTR2BSMN1; SMN2LMNA | |
| SCHEMBL11392849 | 0.74 | HTR2A (0.50) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL7956528 | 0.73 | PTGS2 (0.55) | HTR2AHTR2CHTR2BTUBB1CYP3A4 | |
| SCHEMBL8062101 | 0.72 | TSHR (0.48) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL13144363 | 0.72 | TSHR (0.53) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL11385203 | 0.71 | TSHR (0.41) | TSHRHTR2AHTR2CHTR2BGAA | |
| SCHEMBL9541800 | 0.71 | TSHR (0.57) | TSHRHTR2AHTR2CHTR2BGAA |
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-6245779-B1 | ANALGESICS; ANTIINFLAMMATORY AGENTS | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 2001-06-12 | — | — | US | disclosed |
| EP-0997463-A1 | NAPHTHYRIDINE DERIVATIVES | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 2000-05-03 | — | — | EP | disclosed |