Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.30 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.30 |
| ▸ | MGMT | P16455 | 1/20 | 0.30 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12347748 | 0.80 | POLB (0.35) | — | |
| SCHEMBL15904245 | 0.75 | MAPT (0.50) | NPC1RAB9ASMN1; SMN2MAOBMAOA | |
| SCHEMBL17652128 | 0.74 | NPC1 (0.50) | CASP1CYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL11348815 | 0.73 | — | — | |
| SCHEMBL12495741 | 0.73 | CYP1A2 (0.31) | CASP1CYP1A2MAOBMAOAACHE | |
| SCHEMBL9288630 | 0.69 | TLR8 (0.38) | CYP1A2MAOBMAOAACHE | |
| SCHEMBL10957881 | 0.69 | KDM4E (0.35) | SMN1; SMN2MAOBMAOAACHE | |
| SCHEMBL4448651 | 0.67 | CASP1 (0.77) | CASP1CYP1A2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL1707608 | 0.67 | CASP1 (0.58) | CASP1CYP1A2NPC1RAB9ASMN1; SMN2 | |
| Ethyne SCHEMBL1525159 | 0.65 | CASP1 (0.44) | CASP1CYP1A2NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104918923-A | Novel orally bioavailable respiratory control modulating compounds and methods of use thereof | GALLEON PHARMACEUTICALS INC | 2015-09-16 | — | — | CN | disclosed |