Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.45 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 2/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL63068 | 0.89 | TDP1 (0.67) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL168789 | 0.87 | TDP1 (0.47) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL490320 | 0.87 | TDP1 (0.47) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL30632224 | 0.86 | TDP1 (0.47) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL4594587 | 0.85 | TDP1 (0.49) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL19532995 | 0.85 | LMNA (0.47) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL2531606 | 0.84 | TDP1 (0.65) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL13078900 | 0.84 | TDP1 (0.61) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL20621698 | 0.84 | TDP1 (0.45) | TDP1ALDH1A1CYP3A4CA2TSHR | |
| SCHEMBL18123566 | 0.84 | TDP1 (0.61) | TDP1ALDH1A1CYP3A4CA2TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008119428-A1 | PHOTOSTABLE COMPOSITIONS | MERCK PATENT GMBH (DE) | 2008-10-09 | — | — | WO | disclosed |