Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | SCN1A | P35498 | 2/20 | 0.53 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.53 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CHUK | O15111 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.48 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11563665 | 0.85 | NPC1 (0.64) | RAB9ANPC1MAPTSMN1; SMN2TSHR | |
| SCHEMBL11735128 | 0.81 | NPC1 (0.68) | RAB9ANPC1MAPTSMN1; SMN2TSHR | |
| Irampanel SCHEMBL678128 | 0.78 | HTR7 (0.63) | RAB9ANPC1MAPTSMN1; SMN2HTT | |
| SCHEMBL7961680 | 0.78 | SMN1; SMN2 (0.50) | RAB9ANPC1MAPTSMN1; SMN2TSHR | |
| Irampanel SCHEMBL6879876 | 0.77 | HTR7 (0.62) | RAB9ANPC1MAPTSMN1; SMN2HTT | |
| SCHEMBL11561855 | 0.77 | LMNA (0.59) | RAB9ANPC1MAPTSMN1; SMN2TSHR | |
| SCHEMBL5733694 | 0.76 | GPR55 (0.50) | RAB9ANPC1MAPTSMN1; SMN2TSHR | |
| SCHEMBL11677653 | 0.75 | ALDH1A1 (0.56) | SCN1ASCN2ASCN3ATSHRCYP3A4 | |
| SCHEMBL28245601 | 0.75 | ALDH1A1 (0.63) | SCN1ASCN2ASCN3AMAPTTSHR | |
| SCHEMBL7958621 | 0.74 | GPR55 (0.48) | RAB9ANPC1MAPTSMN1; SMN2TSHR |
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 |