Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL11838374 | 0.82 | ALDH1A1 (0.43) | ALDH1A1HPGDERN1SMN1; SMN2ESR2 | |
| SCHEMBL11845954 | 0.82 | ESR1 (0.38) | ALDH1A1HPGDMEN1KMT2AUSP2 | |
| SCHEMBL11843712 | 0.80 | ESR1 (0.40) | ALDH1A1CYP3A4HPGDMEN1GAA | |
| SCHEMBL11776707 | 0.77 | ALDH1A1 (0.50) | ALDH1A1CYP3A4MAPK1HPGDMEN1 | |
| SCHEMBL6101688 | 0.70 | PGR (0.46) | ALDH1A1MEN1GAAKMT2ASMN1; SMN2 | |
| SCHEMBL11836307 | 0.70 | CYP3A4 (0.43) | CYP3A4MAPK1HPGDMEN1KMT2A | |
| SCHEMBL11839885 | 0.70 | ALDH1A1 (0.52) | ALDH1A1HPGDSMN1; SMN2CA1CA2 | |
| SCHEMBL11844073 | 0.68 | HK2 (0.41) | CYP3A4MAPK1HPGDGAASMN1; SMN2 | |
| SCHEMBL11843906 | 0.67 | ESR2 (0.70) | ALDH1A1HPGDMEN1GAAKMT2A | |
| SCHEMBL23640287 | 0.65 | CYP3A4 (0.56) | ALDH1A1CYP3A4MAPK1HPGDERN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3987186-A | ANTIALLERGENS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-10-19 | — | — | US | disclosed |