Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22452573 | 0.85 | EPHX2 (0.57) | EPHX2HIF1ACYP2C9CNR2 | |
| SCHEMBL22453545 | 0.81 | HPGD (0.52) | EPHX2HIF1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL22452572 | 0.81 | MAPT (0.45) | EPHX2HIF1ASMN1; SMN2TP53CYP2C9 | |
| SCHEMBL22453409 | 0.80 | HIF1A (0.49) | HIF1ANPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL22453417 | 0.78 | CYP11B1 (0.48) | EPHX2HIF1ANPC1CYP2C9ALDH1A1 | |
| SCHEMBL22453411 | 0.77 | SYK (0.39) | HIF1ARAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL22453416 | 0.76 | HIF1A (0.42) | HIF1ANPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL22452687 | 0.76 | EPHX2 (0.53) | EPHX2NPC1SMN1; SMN2CYP2C9CNR2 | |
| SCHEMBL22452517 | 0.74 | CYP11B1 (0.43) | — | |
| SCHEMBL22453408 | 0.73 | HIF1A (0.40) | HIF1ANPC1MAPK1CNR2 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |