Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.51 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.50 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL329575 | 0.83 | ALOX5 (0.62) | LTA4HMEN1PLA2G2AKMT2ASRD5A2 | |
| Indole SCHEMBL15320969 | 0.79 | ALOX5 (0.61) | LTA4HPLA2G2ASRD5A2PDGFRBPDGFRA | |
| SCHEMBL9525385 | 0.78 | ALOX5 (0.53) | MEN1KMT2ASRD5A2PDGFRBPDGFRA | |
| Hexane SCHEMBL27537617 | 0.78 | ALOX5 (0.53) | LTA4HMEN1KMT2ASRD5A2PDGFRB | |
| Indole SCHEMBL2262674 | 0.76 | TRPA1 (0.53) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| Indole SCHEMBL22750244 | 0.76 | TRPA1 (0.53) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL8228019 | 0.76 | CYP2A6 (0.57) | LTA4HSRD5A2PDGFRBPDGFRAKDM4E | |
| Pyridine SCHEMBL28518713 | 0.76 | ALOX5 (0.53) | LTA4HPLA2G2ASRD5A2PDGFRBPDGFRA | |
| Ethoxycarbonyl Group SCHEMBL27370045 | 0.76 | NSD2 (0.48) | MEN1HSP90AA1KMT2ASRD5A2PDGFRB | |
| Tert-Butyl Formate SCHEMBL27752473 | 0.76 | NSD2 (0.48) | MEN1KMT2ASRD5A2PDGFRBPDGFRA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997046525-A1 | 5-ALKOXY-TRYPTAMINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS 5-HT1D RECEPTOR AGONISTS | ALLELIX BIOPHARMACEUTICALS INC. (CA) | 1997-12-11 | — | — | WO | disclosed |
| US-5654431-A | EXHIBIT SELECTIVITY TOWARDS 5-HYDROXYTRYPTAMINE RECEPTORS OF BRAIN CELLS | ALLELIX BIOPHARMACEUTICALS INC. (CA) | 1997-08-05 | — | — | US | disclosed |