Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 4/20 | 0.58 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | ASPH | Q12797 | 1/20 | 0.52 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | CASP7 | P55210 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | GSK3A | P49840 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16634682 | 1.00 | HCAR3 (0.58) | HCAR3AKR1C3AKR1C2KDM4EASPH | |
| SCHEMBL4946668 | 0.79 | KDM4E (0.60) | KDM4ETDP1MAPK1ALDH1A1CASP7 | |
| SCHEMBL9995235 | 0.79 | KMT2A (0.61) | KDM4EASPHKDM8TDP1MAPK1 | |
| SCHEMBL3845592 | 0.79 | AHR (0.61) | TDP1MAPK1ALDH1A1CASP7L3MBTL1 | |
| SCHEMBL11461253 | 0.79 | HCAR3 (0.67) | HCAR3AKR1C3AKR1C2KDM4EALDH1A1 | |
| SCHEMBL16634582 | 0.79 | TDP1 (0.73) | HCAR3AKR1C3AKR1C2TDP1MAPK1 | |
| SCHEMBL16634580 | 0.79 | TDP1 (0.73) | HCAR3AKR1C3AKR1C2TDP1MAPK1 | |
| SCHEMBL11563643 | 0.77 | HCAR3 (0.65) | HCAR3KDM4EMEN1KMT2APOLB | |
| SCHEMBL11566527 | 0.77 | HCAR3 (0.65) | HCAR3KDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4940849 | 0.76 | MAPT (0.48) | KDM4ETDP1MAPK1ALDH1A1CASP7 |
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 |