Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL16881551 | 0.85 | KDM4E (0.52) | MLYCDHSD17B10KDM4ESLC6A2SLC6A4 | |
| SCHEMBL17909852 | 0.80 | CCNC (0.40) | SLC6A2SLC6A4SLC6A3RAB9ANPC1 | |
| SCHEMBL16881489 | 0.79 | ORAI1 (0.49) | SLC6A2SLC6A4SLC6A3MAPTCTNNB1 | |
| SCHEMBL17909821 | 0.79 | CCNC (0.39) | SLC6A2SLC6A4SLC6A3RAB9ANPC1 | |
| SCHEMBL8523959 | 0.75 | RAB9A (0.71) | HSD17B10RAB9ANPC1MAPTATR | |
| SCHEMBL28630199 | 0.74 | MLYCD (0.65) | MLYCDHSD17B10KDM4ERAB9ANPC1 | |
| SCHEMBL9717426 | 0.74 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3RAB9ANPC1 | |
| SCHEMBL27384168 | 0.74 | ATR (0.43) | SLC6A2SLC6A4SLC6A3RAB9ANPC1 | |
| SCHEMBL14426585 | 0.73 | MLYCD (0.54) | MLYCDHSD17B10KDM4ERAB9ANPC1 | |
| SCHEMBL15979921 | 0.73 | CTNNB1 (0.71) | MAP2K1CTNNB1WNT3A |
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-3089746-A1 | THERAPEUTIC INHIBITORY COMPOUNDS | Lifesci Pharmaceuticals, Inc. (BB) | 2016-11-09 | — | — | EP | disclosed |
| WO-2015103317-A1 | THERAPEUTIC INHIBITORY COMPOUNDS | LIFESCI PHARMACEUTICALS, INC. (BB) | 2015-07-09 | — | — | WO | disclosed |