Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.50 |
| ▸ | PPARA | Q07869 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11845535 | 0.82 | CYP1A2 (0.44) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL17420505 | 0.82 | CYP3A4 (0.47) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL30628200 | 0.82 | CYP3A4 (0.47) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL8872566 | 0.78 | MAPT (0.41) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL2985561 | 0.78 | TDP1 (0.44) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL6812442 | 0.78 | TSHR (0.59) | TSHRCYP3A4ABCB11CYP1A2HTR2A | |
| SCHEMBL8591916 | 0.77 | TSHR (0.48) | TSHRCYP3A4CYP1A2PPARAMAPT | |
| SCHEMBL2175864 | 0.77 | TSHR (0.48) | TSHRCYP3A4MAPTALDH1A1MEN1 | |
| SCHEMBL22937465 | 0.77 | TSHR (0.48) | TSHRCYP3A4MAPTALDH1A1MEN1 | |
| SCHEMBL27772056 | 0.76 | ABCB11 (0.47) | TSHRCYP3A4ABCB11CYP1A2HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0099165-A1 | Triazole and imidazole compounds, process for their preparation and their use as fungicides and plant growth regulators, and intermediates for their synthesis | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-01-25 | — | — | EP | disclosed |