Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | BCR | P11274 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4248295 | 0.84 | KMT2A (0.34) | MEN1KMT2ARAB9AMAPTALDH1A1 | |
| SCHEMBL160792 | 0.79 | GSTP1 (0.42) | ESR1ESR2MEN1KMT2ACYP1A2 | |
| SCHEMBL9418157 | 0.72 | ESR1 (0.47) | ESR1ESR2MMP3BCL2L1APP | |
| SCHEMBL7200530 | 0.69 | ESR2 (0.45) | ESR1ESR2MMP3BCL2L1APP | |
| SCHEMBL6400913 | 0.68 | ESR2 (0.44) | ESR1ESR2MMP3BCL2L1APP | |
| SCHEMBL6400555 | 0.68 | ESR1 (0.43) | ESR1ESR2MMP3BCL2L1APP | |
| Naphthalene SCHEMBL11342178 | 0.67 | ESR1 (0.76) | ESR1ESR2MMP3BCL2L1APP | |
| SCHEMBL9418173 | 0.67 | ESR2 (0.43) | ESR1ESR2MMP3BCL2L1APP | |
| SCHEMBL995112 | 0.67 | KDM4E (0.39) | MEN1KMT2ACYP1A2MAPTALDH1A1 | |
| Anthracene SCHEMBL27695029 | 0.65 | CYP1A2 (0.68) | ESR1ESR2MMP3BCL2L1APP |
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-0166509-B1 | PHENOL DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1992-05-13 | — | — | EP | disclosed |