Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | DGKA | P23743 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | PAM | P19021 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1100610 | 0.98 | CYP1A2 (0.52) | TSHRALDH1A1ALOX15TDP1DGKA | |
| SCHEMBL7276581 | 0.92 | CYP1A2 (0.53) | TSHRALDH1A1ALOX15TDP1DGKA | |
| SCHEMBL4900028 | 0.87 | DGKA (0.58) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL16351434 | 0.86 | DGKA (0.67) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL9586966 | 0.86 | DGKA (0.61) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL9276669 | 0.86 | DGKA (0.67) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL16351435 | 0.86 | DGKA (0.67) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL1100388 | 0.84 | CYP1A2 (0.47) | TSHRALDH1A1ALOX15TDP1DGKA | |
| SCHEMBL7042627 | 0.82 | DGKA (0.61) | TSHRALDH1A1DGKADNM1PAM | |
| SCHEMBL16062669 | 0.82 | DGKA (0.52) | TSHRALDH1A1ALOX15TDP1DGKA |
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-5380936-A | Thermal rearrangements | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-01-10 | — | — | US | claimed |
| US-5380936-A | Thermal rearrangements | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-01-10 | — | — | US | disclosed |