Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7362588 | 1.00 | LMNA (0.36) | LMNACYP3A4ALDH1A1HRH1KDM4E | |
| SCHEMBL17180937 | 0.78 | ALDH1A1 (0.33) | CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL10716124 | 0.73 | CYP3A4 (0.38) | CYP3A4ALDH1A1KMT2A | |
| SCHEMBL10815549 | 0.69 | HTR1A (0.33) | — | |
| SCHEMBL308887 | 0.67 | CYP3A4 (0.33) | CYP3A4ALDH1A1 | |
| SCHEMBL14877508 | 0.66 | ALDH1A1 (0.37) | CYP3A4ALDH1A1 | |
| SCHEMBL7356642 | 0.65 | FFAR3 (0.35) | — | |
| Acrylic Acid SCHEMBL7144997 | 0.64 | LMNA (0.67) | LMNAALDH1A1HSD17B10 | |
| SCHEMBL15662580 | 0.64 | CYP3A4 (0.35) | CYP3A4ALDH1A1 | |
| Bicarbonate SCHEMBL4345305 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0753003-A1 | AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1997-01-15 | — | — | EP | disclosed |
| WO-1995028416-A1 | AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-10-26 | — | — | WO | disclosed |