Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL11371012 | 0.97 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| SCHEMBL366715 | 0.97 | ALDH1A1 (0.48) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| SCHEMBL29647544 | 0.97 | ALDH1A1 (0.48) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| SCHEMBL29212557 | 0.94 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Biphenyl SCHEMBL9579764 | 0.94 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Water SCHEMBL7865200 | 0.94 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Hydrochloric Acid SCHEMBL28896072 | 0.94 | ALDH1A1 (0.46) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Biphenyl SCHEMBL7872958 | 0.92 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Biphenyl SCHEMBL4395361 | 0.92 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 | |
| Biphenyl SCHEMBL7874532 | 0.92 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP2A6HPGDBCL2L1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000068237-A1 | PD- AND NI COMPLEXES OF BIPHENYL-2-YL-PHOSPHANES AND THEIR USE IN CATALYTIC C,C-, C,N- AND C,O-COUPLINGS | CLARIANT GMBH (DE) | 2000-11-16 | — | — | WO | disclosed |