Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18557130 | 1.00 | MEN1 (0.58) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL782301 | 1.00 | MEN1 (0.58) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL4031522 | 0.95 | MEN1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL28243450 | 0.95 | L3MBTL1 (0.58) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL106948 | 0.95 | L3MBTL1 (0.58) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL18468590 | 0.90 | L3MBTL1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL4201340 | 0.90 | L3MBTL1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL18468613 | 0.90 | L3MBTL1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL16332656 | 0.90 | L3MBTL1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD | |
| SCHEMBL29385431 | 0.90 | L3MBTL1 (0.54) | MEN1KMT2AHTTALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-105492435-A | N,6-bis(aryl or heteroaryl)-1,3,5-triazine-2,4-diamine compounds as IDH2 mutants inhibitors for the treatment of cancer | AGIOS PHARMACEUTICALS INC | 2016-04-13 | — | — | CN | disclosed |