Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 2/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2652312 | 0.85 | GLA (0.45) | GRM5TACR1MRGPRX4MAOAMAOB | |
| SCHEMBL2650061 | 0.84 | IDO1 (0.42) | CYP3A4IDO1ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL2651467 | 0.82 | IDO1 (0.44) | IDO1AGXTNPC1RAB9AMAOB | |
| SCHEMBL2651154 | 0.81 | MRGPRX4 (0.52) | SMN1; SMN2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL2652010 | 0.77 | IDO1 (0.40) | IDO1KMT2ANPC1RAB9ANR4A2 | |
| SCHEMBL2652551 | 0.76 | FFAR1 (0.41) | ALDH1A1SMN1; SMN2KDM4EKMT2ATDP1 | |
| SCHEMBL2650837 | 0.74 | IDO1 (0.51) | CYP3A4IDO1AGXTNR4A2TACR1 | |
| SCHEMBL2650379 | 0.74 | KAT6A (0.33) | IDO1ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL6745046 | 0.73 | CYP3A4 (0.50) | CYP3A4IDO1AGXTNR4A2TACR1 | |
| SCHEMBL2650744 | 0.73 | MAPK14 (0.37) | ALDH1A1TACR1 |
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 |