Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 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 | |
|---|---|---|---|---|
| SCHEMBL491053 | 0.78 | ALDH1A1 (0.39) | KMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL490735 | 0.74 | ALDH1A1 (0.41) | KMT2AALDH1A1CYP1A2SMN1; SMN2HSD17B10 | |
| SCHEMBL5554839 | 0.73 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2CYP11B1CYP11B2ADORA2A | |
| SCHEMBL8664748 | 0.73 | CYP1A2 (0.48) | KDM4EALDH1A1CYP1A2SMN1; SMN2HSD17B10 | |
| SCHEMBL14973574 | 0.73 | NPC1 (0.41) | KMT2AKDM4EMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL490744 | 0.73 | NPY5R (0.44) | KMT2AKDM4EMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL150156 | 0.73 | ALDH1A1 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL491016 | 0.73 | BACE1 (0.41) | ADORA2AADORA1 | |
| SCHEMBL8664760 | 0.71 | NPC1 (0.49) | KDM4EALDH1A1 | |
| SCHEMBL491164 | 0.71 | MEN1 (0.44) | KMT2AKDM4EMEN1ALDH1A1CYP1A2 |
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-5792589-A | ORGANIC BINDER; OPTICALLY CROSSLINKABLE COMPOUND; RADICAL-GENERATING AGENT: 2,4,5-TRIARYL IMIDAZOLE DIMER, AMINO-GROUP CONTAINING BENZOPHENONE PHOTOSENSITIZER, A THIOL COMPOUND | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1998-08-11 | — | — | US | disclosed |