Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8744959 | 0.87 | AKR1C1 (0.43) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL8744893 | 0.81 | ALDH1A1 (0.34) | ALDH1A1ESR1POLBL3MBTL1 | |
| SCHEMBL8744879 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL11211096 | 0.76 | RAB9A (0.39) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL14130850 | 0.72 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL15969889 | 0.72 | TDP1 (0.43) | ALDH1A1TSHRPOLBMAPTKMT2A | |
| SCHEMBL15969887 | 0.72 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL15052966 | 0.72 | AKR1C3 (0.48) | ALDH1A1TSHRAKR1C1POLBMAPT | |
| SCHEMBL1637843 | 0.71 | AKR1C1 (0.45) | ALDH1A1TSHRAKR1C1ESR1POLB | |
| SCHEMBL1637837 | 0.71 | AKR1C1 (0.45) | ALDH1A1TSHRAKR1C1ESR1POLB |
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-0754693-A2 | Novel aminophenylphosphonic acid derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1997-01-22 | — | — | EP | disclosed |