Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 5/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11257728 | 0.82 | TPMT (0.41) | ALDH1A1HSD17B10CA1CA2CA12 | |
| SCHEMBL13537088 | 0.80 | AKR1C4 (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL11045768 | 0.80 | TRPV4 (0.44) | ALDH1A1TP53ACLYCA1CA2 | |
| SCHEMBL3531626 | 0.80 | AKR1C2 (0.58) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL15575082 | 0.79 | AKR1C4 (0.43) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL11052920 | 0.75 | CA1 (0.42) | CYP3A4ALDH1A1TP53HSD17B10HPGD | |
| SCHEMBL5671303 | 0.75 | AKR1C4 (0.61) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL27705723 | 0.75 | AKR1C4 (0.50) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL3524715 | 0.74 | ALDH1A1 (0.57) | AKR1C4AKR1C3AKR1C2AKR1C1ALDH1A1 | |
| SCHEMBL196272 | 0.74 | TRPV4 (0.37) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2297103-B1 | HYDROXYPHENYLSULFONAMIDES AS ANTIAPOPTOTIC BCL INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2012-01-04 | — | — | EP | disclosed |