Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27168484 | 0.81 | ALDH1A1 (0.47) | MAPK1KDM4EL3MBTL1ALDH1A1HPGD | |
| SCHEMBL30777212 | 0.81 | ALDH1A1 (0.47) | MAPK1KDM4EL3MBTL1ALDH1A1HPGD | |
| SCHEMBL30061686 | 0.81 | ALDH1A1 (0.47) | MAPK1KDM4EL3MBTL1ALDH1A1HPGD | |
| SCHEMBL64414 | 0.80 | HCAR3 (0.71) | MAPK1KDM4EL3MBTL1ALDH1A1TSHR | |
| SCHEMBL3499186 | 0.78 | SIRT2 (0.68) | HDAC1KDM4EALDH1A1HPGDTSHR | |
| SCHEMBL18131757 | 0.76 | HDAC1 (0.56) | HDAC1ALDH1A1HPGDTSHRHDAC3 | |
| SCHEMBL31525845 | 0.76 | NPC1 (0.50) | MAPK1KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL13739418 | 0.76 | MAPK1 (0.61) | MAPK1KDM4EL3MBTL1ALDH1A1HCAR3 | |
| SCHEMBL28382270 | 0.76 | ALDH1A1 (0.43) | MAPK1KDM4EL3MBTL1ALDH1A1HPGD | |
| SCHEMBL1702183 | 0.74 | RAB9A (0.49) | MAPK1KDM4EL3MBTL1ALDH1A1HCAR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015052675-A1 | SUBSTITUTED DIHYDRO-BENZIMIDAZOLE COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2015-04-16 | — | — | WO | disclosed |