Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2652551 | 0.89 | FFAR1 (0.41) | TSHRALDH1A1MAOBNPC1RAB9A | |
| SCHEMBL2651003 | 0.84 | IDO1 (0.40) | IDO1ALDH1A1MAOBPARP10NPC1 | |
| SCHEMBL2652007 | 0.84 | TSHR (0.43) | TSHRALDH1A1MAOBKDM4E | |
| SCHEMBL2652010 | 0.84 | IDO1 (0.40) | IDO1MAOBNPC1RAB9A | |
| SCHEMBL2650713 | 0.84 | MAPK14 (0.37) | TSHRALDH1A1NPC1RAB9ASGMS2 | |
| SCHEMBL2650913 | 0.82 | IDO1 (0.50) | IDO1TSHRALDH1A1PARP10NPC1 | |
| SCHEMBL2651078 | 0.81 | IDO1 (0.44) | IDO1ALDH1A1MAOBSMN1; SMN2 | |
| SCHEMBL2650110 | 0.81 | TP53 (0.41) | TSHRALDH1A1MAOBSGMS2FFAR1 | |
| SCHEMBL2650879 | 0.80 | ALDH1A1 (0.48) | TSHRALDH1A1MAOBSGMS2CYP1A2 | |
| SCHEMBL2650744 | 0.77 | MAPK14 (0.37) | TSHRALDH1A1SGMS2FFAR1MMP1 |
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 |