Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 14/20 | 0.68 |
| ▸ | FABP3 | P05413 | 8/20 | 0.68 |
| ▸ | FABP5 | Q01469 | 5/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.53 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | DHFR | P00374 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MPO | P05164 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.53 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.53 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4256425 | 0.83 | FABP4 (0.65) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL28565383 | 0.81 | FABP4 (1.00) | FABP4FABP3FABP5MEN1LMNA | |
| SCHEMBL28549954 | 0.81 | FABP4 (1.00) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL28550192 | 0.81 | FABP4 (1.00) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL22720389 | 0.81 | PBRM1 (0.67) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL28553901 | 0.81 | FABP4 (1.00) | FABP4FABP3FABP5MEN1AKR1C3 | |
| SCHEMBL24021598 | 0.80 | CLCN2 (0.61) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL355549 | 0.79 | FABP4 (0.80) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL30320327 | 0.79 | FABP4 (0.80) | FABP4FABP3FABP5MEN1AKR1B10 | |
| SCHEMBL30462488 | 0.79 | FABP4 (0.82) | FABP4FABP3FABP5MEN1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112745237-B | 2-arylamine compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2023-06-20 | — | — | CN | disclosed |
| CN-112745237-A | 2-arylamine compound and preparation method and application thereof | 中国科学院上海药物研究所 | 2021-05-04 | — | — | CN | disclosed |