Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PRKCA | P17252 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.37 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL62519 | 0.91 | LMNA (0.51) | ALDH1A1PRKCAKMT2AADRB2ADRB1 | |
| SCHEMBL3894587 | 0.91 | PRKCA (0.36) | ALDH1A1PRKCAMEN1KMT2AESR1 | |
| SCHEMBL6917169 | 0.91 | MAPT (0.49) | ALDH1A1PRKCAKMT2AESR1CA12 | |
| SCHEMBL3390 | 0.90 | ALDH1A1 (0.55) | ALDH1A1PRKCAMEN1KMT2AADRB2 | |
| SCHEMBL4529776 | 0.87 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2ALMNACYP3A4 | |
| Benzocaine SCHEMBL7263677 | 0.83 | LMNA (0.69) | ALDH1A1ESR1CA12CA1CA2 | |
| Ether SCHEMBL13280294 | 0.82 | LMNA (0.46) | ALDH1A1PRKCAMEN1KMT2AADRB2 | |
| SCHEMBL4372826 | 0.80 | ALDH1A1 (0.47) | ALDH1A1PRKCACA2LMNACYP3A4 | |
| SCHEMBL93977 | 0.77 | OR51E2 (0.50) | ALDH1A1LMNATDP1OR51E2 | |
| SCHEMBL28435880 | 0.76 | PDE4A (0.46) | ALDH1A1PRKCAMEN1KMT2AESR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-9124760-A | — | — | None | — | — | JP | disclosed |
| JP-H09124760-A | PRODUCTION OF RIGID POLYISOCYANURATE FOAM | SANYO CHEM IND LTD | 1997-05-13 | — | — | JP | disclosed |