Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 4/20 | 0.62 |
| ▸ | NPC1 | O15118 | 6/20 | 0.60 |
| ▸ | ATM | Q13315 | 2/20 | 0.60 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | CASP3 | P42574 | 2/20 | 0.53 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.53 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.50 |
| ▸ | RELA | Q04206 | 4/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7956850 | 0.75 | GPR55 (0.52) | NPC1ATMGPR55RAB9ACASP3 | |
| Irampanel SCHEMBL678128 | 0.75 | HTR7 (0.63) | HTR7NPC1GPR55RAB9ACASP3 | |
| SCHEMBL7961737 | 0.75 | GPR55 (0.59) | NPC1ATMGPR55RAB9ACASP3 | |
| Irampanel SCHEMBL6879876 | 0.74 | HTR7 (0.62) | HTR7NPC1GPR55RAB9ACASP3 | |
| SCHEMBL7958852 | 0.73 | GPR55 (0.50) | NPC1ATMGPR55RAB9ACASP3 | |
| SCHEMBL5733694 | 0.73 | GPR55 (0.50) | NPC1ATMGPR55RAB9ACASP3 | |
| SCHEMBL7947777 | 0.73 | TP53 (0.47) | HTR7NPC1ATMGPR55RAB9A | |
| SCHEMBL11623649 | 0.73 | TSHR (0.54) | NPC1ATMRAB9ACASP3SENP8 | |
| SCHEMBL7961680 | 0.73 | SMN1; SMN2 (0.50) | HTR7NPC1ATMGPR55RAB9A | |
| SCHEMBL6428833 | 0.72 | SMN1; SMN2 (0.62) | NPC1ATMGPR55RAB9ACASP3 |
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-6277872-B1 | ANTIISCHEMIC AGENTS; BRAIN DISORDERS | BOEHRINGER INGELHEIM KG (DE) | 2001-08-21 | — | — | US | disclosed |