Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | RXRA | P19793 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 2/20 | 0.47 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | FNTA | P49354 | 3/20 | 0.46 |
| ▸ | FNTB | P49356 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.41 |
| ▸ | F7 | P08709 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11617265 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP19A1RXRAPPARG | |
| SCHEMBL1905069 | 0.87 | — | — | |
| SCHEMBL1905071 | 0.87 | — | — | |
| SCHEMBL9651209 | 0.87 | — | — | |
| SCHEMBL1298898 | 0.85 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP19A1RXRAPPARG | |
| SCHEMBL1298900 | 0.85 | ALDH1A1 (0.56) | ALDH1A1MAPTCYP19A1RXRAPPARG | |
| SCHEMBL30839918 | 0.82 | KMT2A (0.65) | ALDH1A1MAPTFNTAFNTBKMT2A | |
| SCHEMBL25236755 | 0.81 | KMT2A (0.50) | ALDH1A1MAPTFNTAFNTBKMT2A | |
| SCHEMBL1298997 | 0.81 | KMT2A (0.50) | ALDH1A1MAPTFNTAFNTBKMT2A | |
| SCHEMBL1298995 | 0.81 | KMT2A (0.50) | ALDH1A1MAPTFNTAFNTBKMT2A |
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-4116955-A | META-CYCLOPHANE AND A TRANS-TERPENOID, SEPARATION OF ISOMERS | TEIJIN LIMITED (JP) | 1978-09-26 | — | — | US | disclosed |