Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 4/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1199602 | 0.82 | CHRM1 (0.59) | NISCHCHRM1ALDH1A1CNR1NTSR1 | |
| SCHEMBL12876624 | 0.82 | CHRM1 (0.59) | NISCHCHRM1CNR1NTSR1OPRK1 | |
| SCHEMBL29414926 | 0.82 | CHRM1 (0.59) | NISCHCHRM1ALDH1A1CNR1NTSR1 | |
| SCHEMBL11460470 | 0.82 | CHRM1 (0.59) | NISCHCHRM1ALDH1A1CNR1NTSR1 | |
| SCHEMBL1199345 | 0.81 | NISCH (0.54) | NISCHADRA2AADRA2BADRA2C | |
| SCHEMBL1198373 | 0.80 | KDM4E (0.50) | NISCHCHRM1ALDH1A1CNR1NTSR1 | |
| SCHEMBL11678875 | 0.79 | CHRM1 (0.62) | NISCHCHRM1ALDH1A1CNR1NTSR1 | |
| SCHEMBL12707822 | 0.79 | NISCH (0.41) | NISCHALDH1A1KDM4EMEN1NPC1 | |
| SCHEMBL11852207 | 0.79 | KDM4E (0.43) | NISCHALDH1A1CNR1NTSR1OPRK1 | |
| SCHEMBL1199546 | 0.79 | AURKA (0.50) | NISCHALDH1A1KDM4EMEN1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007072041-A1 | THERAPEUTIC COMPOUNDS | ASTEX THERAPEUTICS LIMITED (GB) | 2007-06-28 | — | — | WO | disclosed |