Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10007758 | 0.98 | TDP1 (0.54) | TDP1CYP19A1ALDH1A1L3MBTL1CYP2C19 | |
| SCHEMBL28223020 | 0.97 | TDP1 (0.56) | TDP1CYP19A1ALDH1A1L3MBTL1CYP2C19 | |
| SCHEMBL21768329 | 0.93 | TDP1 (0.59) | TDP1ALDH1A1L3MBTL1KEAP1NPC1 | |
| SCHEMBL3684586 | 0.89 | EPHX2 (0.57) | TDP1CYP19A1ALDH1A1TAAR1KDM4E | |
| SCHEMBL5652287 | 0.89 | EPHX2 (0.57) | TDP1CYP19A1ALDH1A1TAAR1KDM4E | |
| SCHEMBL22636120 | 0.85 | TDP1 (0.47) | TDP1ALDH1A1KEAP1MGLL | |
| Hydrochloric Acid SCHEMBL4072239 | 0.84 | TDP1 (0.50) | TDP1KEAP1 | |
| SCHEMBL11590642 | 0.84 | POLB (0.47) | TDP1ALDH1A1L3MBTL1CYP2C19TAAR1 | |
| SCHEMBL27824205 | 0.84 | CYP19A1 (0.50) | TDP1CYP19A1ALDH1A1CYP2C19KDM4E | |
| SCHEMBL29200280 | 0.83 | GAA (0.44) | CYP19A1ALDH1A1L3MBTL1CYP2C19TAAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1230175-A | Cytostatic hydroximic acid derivatives | BRITISH BIOTECH PHARM (GB) | 1999-09-29 | — | — | CN | disclosed |
| EP-0925278-A1 | CYTOSTATIC HYDROXAMIC ACID DERIVATIVES | BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) | 1999-06-30 | — | — | EP | disclosed |
| WO-1998011063-A1 | CYTOSTATIC HYDROXAMIC ACID DERIVATIVES | BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) | 1998-03-19 | — | — | WO | disclosed |