Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.44 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27971872 | 0.80 | ALDH1A1 (0.47) | ALDH1A1NTSR1GPR55NPC1RAB9A | |
| SCHEMBL1747905 | 0.73 | ALDH1A1 (0.47) | ALDH1A1NTSR1GPR55NPC1RAB9A | |
| SCHEMBL30108088 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL1358618 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL29560186 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL29008551 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL164 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL2548048 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL4002609 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 | |
| Biphenyl SCHEMBL28890607 | 0.71 | ALDH1A1 (1.00) | ALDH1A1NPC1RAB9ASMN1; SMN2MAPK1 |
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-20200392259-A1 | ORTHOMETALLATED CATALYST COMPONENTS FOR OLEFIN POLYMERIZATION AND COPOLYMERIZATION | ARZOUMANIDIS GREGORY G (US) | 2020-12-17 | — | — | US | disclosed |