Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 8/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.32 |
| ▸ | FLT1 | P17948 | 1/20 | 0.32 |
| ▸ | FLT4 | P35916 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29890650 | 0.79 | NOTUM (0.44) | TSHRCYP3A4TDP1MAPK1HTT | |
| SCHEMBL3324051 | 0.79 | NOTUM (0.44) | TSHRCYP3A4TDP1MAPK1HTT | |
| SCHEMBL12251280 | 0.79 | TSHR (0.41) | TSHRCYP3A4TDP1MAPK1PYCR1 | |
| SCHEMBL10662332 | 0.78 | ALOX15 (0.42) | TSHRCYP3A4TDP1MAPK1PYCR1 | |
| SCHEMBL11683376 | 0.77 | TSHR (0.68) | TSHRCYP3A4TDP1MAPK1TP53 | |
| SCHEMBL11602444 | 0.76 | TSHR (0.44) | TSHRCYP3A4TDP1MAPK1ALOX15 | |
| SCHEMBL14991648 | 0.76 | TSHR (0.39) | TSHRCYP3A4TDP1MAPK1PYCR1 | |
| SCHEMBL19057574 | 0.76 | PGR (0.41) | TSHRCYP3A4TDP1MAPK1PYCR1 | |
| SCHEMBL29464185 | 0.76 | PGR (0.41) | TSHRCYP3A4TDP1MAPK1PYCR1 | |
| SCHEMBL1845000 | 0.75 | TSHR (1.00) | TSHRCYP3A4TDP1MAPK1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | claimed |
| US-4163753-A | FROM AN ALIPHATIC ACID ANHYDRIDE AND A TRICHLOROMETHYL AROMATIC COMPOUND | Diaz Chemical Corporation (US) | 1979-08-07 | — | — | US | disclosed |