Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FABP3 | P05413 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL27930519 | 0.81 | FABP3 (0.41) | CYP1A2CYP3A4HSD17B10PTGS1PTGS2 | |
| SCHEMBL28110787 | 0.79 | ALDH1A1 (0.40) | CYP1A2CYP3A4HSD17B10PTGS1PTGS2 | |
| SCHEMBL29640023 | 0.79 | ALDH1A1 (0.40) | CYP1A2CYP3A4HSD17B10PTGS1PTGS2 | |
| SCHEMBL28388638 | 0.78 | TAAR1 (0.48) | CYP1A2TAAR1TDP1CYP3A4HSD17B10 | |
| SCHEMBL3269166 | 0.78 | CYP2A6 (0.44) | CYP1A2ESR2CYP3A4PTGS1PTGS2 | |
| SCHEMBL27662017 | 0.78 | TAAR1 (0.48) | CYP1A2TAAR1TDP1CYP3A4HSD17B10 | |
| SCHEMBL29368088 | 0.78 | CYP2A6 (0.44) | CYP1A2ESR2CYP3A4PTGS1PTGS2 | |
| SCHEMBL28688413 | 0.78 | RXRA (0.49) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL13176835 | 0.78 | CYP3A4 (0.44) | CYP1A2CYP3A4ALDH1A1LMNACYP2A6 | |
| SCHEMBL27397239 | 0.76 | SMN1; SMN2 (0.44) | CYP1A2CYP3A4HSD17B10PTGS1PTGS2 |
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-2002042246-A1 | METHOD FOR THE PREPARATION OF DICHLORODIARYLMETHANES | TESSENDERLO CHEMIE N.V. (BE) | 2002-05-30 | — | — | WO | disclosed |