Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.67 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | CENPE | Q02224 | 1/20 | 0.55 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.54 |
| ▸ | RORC | P51449 | 1/20 | 0.51 |
| ▸ | TOP1 | P11387 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2104049 | 0.78 | RORC (0.55) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL403840 | 0.77 | RORC (0.56) | KMT2ANPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL2104568 | 0.77 | CENPE (0.53) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL2617141 | 0.77 | CENPE (0.86) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL2104572 | 0.77 | CENPE (0.62) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL2103796 | 0.77 | CENPE (0.62) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL14531252 | 0.77 | RORC (0.54) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL4720085 | 0.76 | CENPE (0.54) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL2105954 | 0.76 | CENPE (0.61) | HDAC1HDAC8HDAC6KMT2ANPC1 | |
| SCHEMBL20786870 | 0.76 | HDAC1 (0.62) | HDAC1HDAC8HDAC6KMT2ANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7618981-B2 | to treat cellular proliferative diseases, hyperplasias, solid tumor, cardiac hypertrophy, immune disorders and inflammation; modulators of one or more mitotic kinesins; N-(2-(2-dimethylamino-acetylamino)-1-{4-[8-(1-hydroxy-ethyl)-imidazo[1,2-a]pyridin-2-yl]-benzyl}-ethyl)-3-chloro-4-isopropoxy-benzamide | CYTOKINETICS, INC. (US) | 2009-11-17 | — | — | US | disclosed |