Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 9/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 2/20 | 0.33 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 2/20 | 0.30 |
| ▸ | SMC2 | O95347 | 1/20 | 0.30 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.30 |
| ▸ | SMC1A | Q14683 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14219642 | 0.89 | TDP1 (0.39) | TDP1MEN1KMT2ANPC1PTGS2 | |
| SCHEMBL14223057 | 0.88 | MAP2K1 (0.41) | TDP1MEN1KMT2AAAK1NPC1 | |
| SCHEMBL14219715 | 0.88 | PTGS2 (0.41) | TDP1MEN1KMT2AALDH1A1PTGS2 | |
| SCHEMBL14219649 | 0.88 | TDP1 (0.38) | TDP1MEN1KMT2APTGS2MAP2K1 | |
| SCHEMBL14223051 | 0.85 | MAP2K1 (0.44) | TDP1MEN1KMT2AAAK1NPC1 | |
| SCHEMBL14223203 | 0.85 | KDM4E (0.36) | TDP1MEN1KMT2ANPC1PTGS2 | |
| SCHEMBL14219711 | 0.84 | MEN1 (0.42) | TDP1MEN1KMT2AAAK1NPC1 | |
| SCHEMBL14220113 | 0.84 | MAP2K1 (0.49) | TDP1MEN1KMT2AAAK1MAP2K1 | |
| SCHEMBL14219644 | 0.83 | MEN1 (0.42) | TDP1MEN1KMT2AAAK1NPC1 | |
| SCHEMBL14222530 | 0.82 | NPC1 (0.40) | NPC1ALDH1A1MAP2K1HDAC3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008041088-A2 | N-HYDROXY BENZAMIDES WITH ANTITUMOR ACTIVITY | EOS (ETHICAL ONCOLOGY SCIENCE) S.P.A. (IT) | 2008-04-10 | — | — | WO | disclosed |
| EP-1908751-A1 | N-hydroxy benzamides with antitumour activity | EOS S.p.A. (IT) | 2008-04-09 | — | — | EP | disclosed |