Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL14015641 | 0.86 | OGA (0.35) | CHRNB2CHRNA4NPSR1ALDH1A1GAA | |
| SCHEMBL15803238 | 0.81 | TDP1 (0.53) | CHRNB2CHRNA4ALDH1A1GAATDP1 | |
| SCHEMBL20665136 | 0.79 | HTR2A (0.47) | TDP1CYP19A1HTR2ACACNA1CAKR1B1 | |
| SCHEMBL16434729 | 0.79 | HRH4 (0.48) | ALDH1A1HTTTDP1CYP19A1HTR2A | |
| SCHEMBL12303262 | 0.79 | PNMT (0.44) | HTTTDP1LMNAHTR2AMAPT | |
| SCHEMBL12938144 | 0.79 | KDM4E (0.34) | ALDH1A1GAAHTTTDP1KDM4E | |
| SCHEMBL13920381 | 0.77 | ACHE (0.36) | CHRNB2CHRNA4ALDH1A1GAAHIF1A | |
| SCHEMBL16434704 | 0.76 | CHRNB2 (0.35) | CHRNB2CHRNA4NPSR1ALDH1A1GAA | |
| SCHEMBL23775858 | 0.75 | ALDH1A1 (0.49) | NPSR1ALDH1A1GAAHTTLMNA | |
| SCHEMBL10199356 | 0.75 | KDM4E (0.40) | CHRNB2CHRNA4NPSR1ALDH1A1GAA |
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-7452911-B2 | Alkyne compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2008-11-18 | — | — | US | disclosed |