Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5595459 | 0.87 | ALDH1A1 (0.38) | ALDH1A1HTR7MYCACHEMAP3K14 | |
| SCHEMBL4609397 | 0.75 | NOTUM (0.37) | ALDH1A1HSD17B10 | |
| SCHEMBL197690 | 0.68 | ACHE (0.64) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL30354037 | 0.68 | ACHE (0.64) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL30169568 | 0.68 | ACHE (0.64) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL598761 | 0.68 | TSHR (0.53) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL4220081 | 0.66 | ABCB1 (0.38) | NPC1RAB9ASMN1; SMN2CASP3SENP8 | |
| Ammonia Solution, Strong SCHEMBL842431 | 0.66 | ACHE (0.60) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| Lithium SCHEMBL31260773 | 0.66 | ACHE (0.60) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 | |
| SCHEMBL6564122 | 0.66 | ACHE (0.60) | ALDH1A1NPC1RAB9ASMN1; SMN2CASP3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007509174-A | — | — | 2007-04-12 | — | — | JP | claimed |
| EP-1675840-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2006-07-05 | — | — | EP | claimed |
| WO-2005044812-A1 | DIHYDROBENZOFURANYL ALKANAMINE DERIVATIVES AS 5HT2C AGONISTS | WYETH A CORPORATION OF THE STATE OF DELAWARE (US) | 2005-05-19 | — | — | WO | claimed |