Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | AGXT | P21549 | 2/20 | 0.51 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 4/20 | 0.44 |
| ▸ | RXRA | P19793 | 1/20 | 0.43 |
| ▸ | RXRB | P28702 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6745046 | 0.89 | CYP3A4 (0.50) | IDO1CYP3A4AGXTTACR1MAOB | |
| SCHEMBL6772852 | 0.76 | MRGPRX4 (0.39) | — | |
| SCHEMBL27606094 | 0.75 | HDAC7 (0.42) | IDO1 | |
| SCHEMBL10314841 | 0.75 | CYP3A4 (0.58) | IDO1CYP3A4AGXTTACR1MAOB | |
| SCHEMBL2650976 | 0.74 | FFAR1 (0.47) | TACR1MAOBFFAR1MAOA | |
| SCHEMBL2651208 | 0.74 | IDO1 (0.54) | IDO1AGXTMAOBFFAR1 | |
| SCHEMBL27625109 | 0.74 | ACP3 (0.40) | IDO1 | |
| SCHEMBL2651330 | 0.74 | CYP3A4 (0.42) | IDO1CYP3A4AGXTTACR1MAOB | |
| SCHEMBL23164237 | 0.73 | CYP3A4 (0.51) | IDO1CYP3A4AGXTTACR1MAOB | |
| SCHEMBL23163975 | 0.73 | CYP3A4 (0.51) | IDO1CYP3A4AGXTTACR1MAOB |
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 |