Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | TERT | O14746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4859288 | 0.98 | ALDH1A1 (0.47) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 | |
| SCHEMBL8877707 | 0.98 | ALDH1A1 (0.47) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 | |
| SCHEMBL8878000 | 0.98 | ALDH1A1 (0.47) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 | |
| SCHEMBL8877927 | 0.98 | ALDH1A1 (0.47) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 | |
| SCHEMBL822758 | 0.89 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDHSD17B10ATM | |
| SCHEMBL6266985 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDHSD17B10ATM | |
| SCHEMBL2861936 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDHSD17B10ATM | |
| SCHEMBL7646895 | 0.83 | CYP1B1 (0.56) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 | |
| SCHEMBL7646919 | 0.83 | KEAP1 (0.48) | ALDH1A1CYP1B1KDM4EATMSMN1; SMN2 | |
| SCHEMBL13001996 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CYP1B1KDM4EHPGDHSD17B10 |
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-5650513-A | Process for preparing perylene-3,4-dicarboxylic acid derivatives, the derivatives thus prepared and their use | CIBA-GEIGY CORPORATION (US) | 1997-07-22 | — | — | US | disclosed |