Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | ACLY | P53396 | 1/20 | 0.48 |
| ▸ | MYC | P01106 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | DHFR | P00374 | 1/20 | 0.45 |
| ▸ | MPO | P05164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2582559 | 0.87 | PTGS2 (0.49) | POLBALDH1A1KMT2ACYP3A4CYP2C9 | |
| Bromide SCHEMBL2582738 | 0.85 | PTGS2 (0.47) | POLBALDH1A1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL13073786 | 0.84 | POLB (0.56) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14976573 | 0.81 | POLB (0.46) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9573786 | 0.79 | EGFR (0.43) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL11141436 | 0.79 | PTGS2 (0.57) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28859305 | 0.79 | POLB (0.50) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL165558 | 0.78 | POLB (0.61) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28278344 | 0.78 | CA12 (0.49) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL26292485 | 0.77 | POLB (0.59) | POLBKDM4EALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9975903-B2 | Condensed heterocyclic compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-05-22 | — | — | US | disclosed |