Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY1R | P25929 | 1/20 | 0.44 |
| ▸ | NPY2R | P49146 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8625167 | 0.82 | HPGD (0.39) | PTPN1PDE4BBCHEDHFR | |
| SCHEMBL7233664 | 0.78 | THRA (0.42) | PTPN1BCHE | |
| SCHEMBL7774653 | 0.78 | THRA (0.42) | PTPN1BCHE | |
| SCHEMBL16518358 | 0.77 | MAPK1 (0.43) | NPY1RNPY2RPTPN1SMN1; SMN2MAPK1 | |
| SCHEMBL2891959 | 0.77 | PDE4B (0.43) | NPY1RNPY2RPTPN1MEN1KMT2A | |
| SCHEMBL30601751 | 0.77 | PDE4B (0.48) | NPY1RNPY2RPTPN1KMT2APDE4B | |
| SCHEMBL30124787 | 0.77 | PDE4B (0.48) | NPY1RNPY2RPTPN1KMT2APDE4B | |
| SCHEMBL28897169 | 0.77 | PDE4B (0.48) | NPY1RNPY2RPTPN1KMT2APDE4B | |
| SCHEMBL27404540 | 0.76 | MAPK1 (0.38) | NPY1RNPY2RPTPN1SMN1; SMN2MAPK1 | |
| SCHEMBL20906593 | 0.76 | NPC1 (0.48) | NPY1RNPY2RMEN1KMT2ANPC1 |
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-5698700-A | Acetylenes disubstituted with 2-tetrahydropyranoxyaryl and aryl or heteroaryl groups having retinoid-like biological activity | ALLERGAN (US) | 1997-12-16 | — | — | US | disclosed |