Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7737542 | 0.81 | NR1H2 (0.49) | MAPTRAB9ACA12CA1CA2 | |
| SCHEMBL11308088 | 0.78 | CA1 (0.51) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL16351874 | 0.78 | CA1 (0.73) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL1965326 | 0.78 | CA1 (0.73) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL9129031 | 0.76 | CA12 (0.56) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL7738427 | 0.76 | NR1H2 (0.53) | NPC1MAPTRAB9AKDM4EKMT2A | |
| SCHEMBL7739199 | 0.76 | HPGD (0.55) | NPC1MAPTRAB9ACA12CA1 | |
| SCHEMBL11878293 | 0.75 | CA1 (0.63) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL7310001 | 0.74 | NPC1 (0.56) | NPC1MAPTRAB9AKDM4EHSP90AA1 | |
| SCHEMBL11309269 | 0.74 | ALDH1A1 (0.50) | MAPTCA12CA1CA2CA7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6416861-B1 | COMBINATORIAL CHEMISTRY | NORTHWESTERN UNIVERSITY | 2002-07-09 | — | — | US | disclosed |
| WO-2000049022-A2 | ORGANOSILICON COMPOUNDS AND USES THEREOF | NORTHWESTERN UNIVERSITY (US) | 2000-08-24 | — | — | WO | disclosed |