Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | PI4KA | P42356 | 1/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.34 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.32 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16581196 | 0.94 | KRAS (0.40) | KRASCYP11B1MIFGABRA1TGFBR1 | |
| SCHEMBL16581225 | 0.92 | KRAS (0.38) | KRASCYP11B1MIFGABRA1TGFBR1 | |
| SCHEMBL16581110 | 0.92 | CYP11B1 (0.39) | KRASCYP11B1MAPK1KDM4EALDH1A1 | |
| SCHEMBL16581208 | 0.90 | PIK3CD (0.37) | KRASMIFGABRA1TGFBR1PIK3CA | |
| SCHEMBL19106367 | 0.89 | CYP11B1 (0.36) | KRASCYP11B1MAPK1ADORA2AADORA1 | |
| SCHEMBL19106353 | 0.89 | CYP11B1 (0.37) | KRASCYP11B1PIK3CAMAPK1KDM4E | |
| SCHEMBL19106373 | 0.89 | CYP11B1 (0.37) | KRASCYP11B1MAPK1KDM4EALDH1A1 | |
| SCHEMBL19106251 | 0.89 | KRAS (0.47) | KRASMIFGABRA1TGFBR1PIK3CA | |
| SCHEMBL19106362 | 0.89 | CYP11B1 (0.35) | KRASCYP11B1MAPK1ADORA2AADORA1 | |
| SCHEMBL16581158 | 0.88 | CYP11B1 (0.37) | KRASCYP11B1PIK3CAKDM4EALDH1A1 |
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-2015037675-A1 | BENZOTHIENOPYRIMIDINE COMPOUND, METHOD FOR PRODUCING SAME AND ORGANIC ELECTROLUMINESCENT ELEMENT CONTAINING SAME | 東ソー株式会社 (JP) | 2015-03-19 | — | — | WO | disclosed |