Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 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 | |
|---|---|---|---|---|
| SCHEMBL11599913 | 0.81 | TSHR (0.44) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL11556772 | 0.80 | TSHR (0.48) | TSHRCYP3A4TDP1ALOX15ALOX12 | |
| SCHEMBL10662332 | 0.78 | ALOX15 (0.42) | TSHRCYP3A4MAPK1TDP1ALOX15 | |
| SCHEMBL11550638 | 0.76 | TSHR (0.60) | TSHRCYP3A4MAPK1TDP1ALOX15 | |
| SCHEMBL10659106 | 0.74 | TSHR (0.43) | TSHRCYP3A4TDP1ALOX15ALOX12 | |
| SCHEMBL11602607 | 0.73 | CYP3A4 (0.36) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL8425257 | 0.73 | TSHR (0.65) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL1538490 | 0.73 | TSHR (0.46) | TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL10969987 | 0.71 | TSHR (0.40) | TSHR | |
| SCHEMBL10969991 | 0.71 | TSHR (0.40) | TSHR |
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-4079090-A | Preparation of trichloromethyl-trifluoro methyl-benzenes | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-14 | — | — | US | claimed |
| US-4079090-A | Preparation of trichloromethyl-trifluoro methyl-benzenes | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-14 | — | — | US | disclosed |