Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.43 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.42 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.42 |
| ▸ | MDM4 | O15151 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL653999 | 0.85 | HDAC1 (0.70) | HDAC1HDAC2HDAC3NCOR2HDAC8 | |
| SCHEMBL651392 | 0.79 | GAA (0.54) | MEN1NPC1RAB9AKMT2ANOX1 | |
| SCHEMBL3836570 | 0.77 | MEN1 (0.56) | HDAC1MEN1NPC1RAB9AKMT2A | |
| SCHEMBL651514 | 0.74 | MEN1 (0.63) | PTPN1MEN1NPC1RAB9AKMT2A | |
| SCHEMBL8228268 | 0.73 | HDAC1 (0.70) | HDAC1HDAC2HDAC3HDAC8HDAC6 | |
| SCHEMBL3680858 | 0.73 | KMT2A (0.71) | HDAC2PTPN1HDAC8HDAC6MEN1 | |
| SCHEMBL13603928 | 0.73 | KMT2A (0.57) | MEN1NPC1RAB9AKMT2ANOX1 | |
| SCHEMBL889852 | 0.73 | MEN1 (0.51) | MEN1NPC1RAB9AKMT2ANOX1 | |
| SCHEMBL30451287 | 0.71 | MEN1 (0.53) | MEN1NPC1RAB9AKMT2ANOX1 | |
| SCHEMBL13644980 | 0.71 | CA1 (0.50) | MEN1NPC1RAB9AKMT2ANOX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2013196-A2 | DISUBSTITUTED ANILINE COMPOUNDS | Merck & Co., Inc. (US) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007127137-A2 | DISUBSTITUTED ANILINE COMPOUNDS | MERCK & CO., INC. (US) | 2007-11-08 | — | — | WO | disclosed |