Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL28307068 | 0.87 | SLC6A4 (0.38) | CHRNB4CHRNA3SLC6A4PTGS1 | |
| SCHEMBL10834009 | 0.80 | LTA4H (0.44) | MEN1KMT2APTGS1 | |
| SCHEMBL11079404 | 0.79 | NPSR1 (0.40) | CNR2MEN1KMT2AHPGD | |
| SCHEMBL3770932 | 0.75 | SRD5A2 (0.44) | NPC1RAB9APOLBCNR2SLC6A4 | |
| SCHEMBL5292439 | 0.75 | NPC1 (0.42) | NPC1RAB9APOLBCNR2SLC6A4 | |
| SCHEMBL11086531 | 0.75 | SLC6A4 (0.43) | SLC6A4SLC6A2SLC6A3MEN1KMT2A | |
| SCHEMBL9918887 | 0.73 | PYCR1 (0.37) | RAB9APYCR1MEN1KMT2AHPGD | |
| SCHEMBL27871817 | 0.73 | SRD5A2 (0.47) | NPC1RAB9APOLBCNR2SLC6A4 | |
| SCHEMBL11087775 | 0.73 | IDO1 (0.41) | SLC6A4SLC6A2SLC6A3KDM4E | |
| SCHEMBL8743586 | 0.72 | KDM4E (0.39) | CHRNB4CHRNA3POLBSLC6A4KDM4E |
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-5861111-A | Method for isomerization of arylpropargyl ether monomers and uses therefor | DEXTER CORPORATION (US) | 1999-01-19 | — | — | US | disclosed |