Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 2/20 | 0.39 |
| ▸ | CCND1 | P24385 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2651617 | 0.83 | FFAR1 (0.41) | ESR1CDK4CCND1FFAR1ADRA2A | |
| SCHEMBL2652007 | 0.83 | TSHR (0.43) | MAOBLMNAKDM4E | |
| SCHEMBL2650946 | 0.76 | SYK (0.41) | SLC6A2PTGS1LMNAKDM4E | |
| SCHEMBL12936636 | 0.75 | TAAR1 (0.43) | MAOBCDK4CCND1FFAR1TAAR1 | |
| SCHEMBL2651834 | 0.74 | CTSA (0.40) | ESR1MAOBADRA2ACYP2D6ADRA2B | |
| SCHEMBL2651533 | 0.74 | GLA (0.42) | ESR1FFAR1ADRA2ACYP2D6ADRA2B | |
| SCHEMBL2650945 | 0.73 | GAA (0.46) | CYP2D6CHRM2CHRM1CHRM3LMNA | |
| SCHEMBL6202860 | 0.72 | ESR1 (0.52) | ESR1ADRA2ACYP2D6ADRA2BSLC22A2 | |
| SCHEMBL10851642 | 0.72 | MAOB (0.44) | MAOBCDK4CCND1FFAR1TAAR1 | |
| SCHEMBL2650236 | 0.71 | IDO1 (0.48) | MAOBTAAR1IDO1 |
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-1404335-A1 | AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS | Astrazeneca AB (SE) | 2004-04-07 | — | — | EP | disclosed |
| WO-2003000267-A1 | AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS | ASTRAZENECA AB (SE) | 2003-01-03 | — | — | WO | disclosed |