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 |
| ▸ | CA1 | P00915 | 2/20 | 0.64 |
| ▸ | CA2 | P00918 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 4/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | HNF4A | P41235 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | USP2 | O75604 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL28804050 | 0.89 | HIF1A (0.59) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL28005872 | 0.84 | HSD17B10 (0.68) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL27924524 | 0.81 | KLKB1 (0.67) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL29414416 | 0.81 | KLKB1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL160646 | 0.81 | KLKB1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| SCHEMBL27626950 | 0.79 | HIF1A (0.79) | HPGDHSD17B10HIF1ACYP3A4MEN1 | |
| 5-Chlorosalicylic Acid SCHEMBL130605 | 0.79 | CA1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| 5-Chlorosalicylic Acid SCHEMBL29499764 | 0.79 | CA1 (1.00) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| 5-Chlorosalicylic Acid SCHEMBL6855770 | 0.77 | CA1 (0.96) | KLKB1CTSBMMP9DNMT1DNMT3B | |
| 5-Chlorosalicylic Acid SCHEMBL943143 | 0.77 | CA1 (0.96) | 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 |