Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 1/20 | 0.67 |
| ▸ | CTSB | P07858 | 1/20 | 0.67 |
| ▸ | MMP9 | P14780 | 1/20 | 0.67 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.67 |
| ▸ | DNMT3B | Q9UBC3 | 1/20 | 0.67 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.67 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.67 |
| ▸ | HNF4A | P41235 | 1/20 | 0.59 |
| ▸ | LCK | P06239 | 2/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL27906555 | 0.89 | KLKB1 (0.51) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL27906560 | 0.81 | KLKB1 (0.58) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL27906556 | 0.81 | KLKB1 (0.67) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL29414416 | 0.81 | KLKB1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL160646 | 0.81 | KLKB1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL30352763 | 0.79 | CYP2C9 (0.72) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL129669 | 0.79 | CYP2C9 (0.72) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL9487167 | 0.77 | CYP2C9 (0.69) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL1858652 | 0.76 | HPGD (0.62) | HPGDALOX15ALOX5ALDH1A1HTT | |
| SCHEMBL19303674 | 0.76 | KLKB1 (0.69) | KLKB1CTSBMMP9DNMT1DNMT3B |
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-103086908-B | N-benzylaniline derivatives and application thereof | UNIV NANJING MEDICAL | 2015-05-13 | — | — | CN | claimed |
| CN-103086908-A | N-benzylaniline derivatives and application thereof | UNIV NANJING MEDICAL | 2013-05-08 | — | — | CN | claimed |
| CN-103086908-B | N-benzylaniline derivatives and application thereof | UNIV NANJING MEDICAL | 2015-05-13 | — | — | CN | disclosed |