Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 7/20 | 0.66 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.66 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.59 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.59 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.59 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.59 |
| ▸ | HRH1 | P35367 | 1/20 | 0.59 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.59 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.59 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.59 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.59 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL12441787 | 1.00 | CHRM2 (0.66) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL28495177 | 0.91 | CHRM2 (0.54) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL20045514 | 0.86 | CHRM2 (0.71) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL18911063 | 0.84 | CHRM2 (0.49) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL6700758 | 0.84 | CHRM2 (0.60) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL6704158 | 0.84 | CHRM2 (0.60) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL1847210 | 0.84 | CHRM2 (0.60) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL9910958 | 0.83 | CHRM2 (0.68) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL10370745 | 0.83 | CHRM2 (0.58) | CHRM2CHRM1CYP2D6KCNH2CHRM3 | |
| SCHEMBL18905507 | 0.83 | CHRM2 (0.48) | CHRM2CHRM1CYP2D6KCNH2CHRM3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2227233-A2 | IDO INHIBITORS | Newlink Genetics (US) | 2010-09-15 | — | — | EP | disclosed |
| WO-2009073620-A2 | IDO INHIBITORS | NEWLINK GENETICS (US) | 2009-06-11 | — | — | WO | disclosed |