Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 3/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 5/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 5/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2650946 | 0.81 | SYK (0.41) | GABRA1GABRG2GABRB3GABRA5GABRA3 | |
| SCHEMBL2652142 | 0.74 | ESR1 (0.42) | OPRM1ESR1KCNH2MAOBCYP2D6 | |
| SCHEMBL13316241 | 0.74 | CCR1 (0.40) | OPRM1MEN1OPRD1KMT2AGABRA1 | |
| SCHEMBL2651617 | 0.70 | FFAR1 (0.41) | CTSAMEN1KMT2AGABRA5ESR1 | |
| SCHEMBL2650945 | 0.70 | GAA (0.46) | MEN1KMT2AMAPTCYP2D6CHRM2 | |
| SCHEMBL16587856 | 0.69 | MEN1 (0.38) | OPRM1MEN1OPRD1KMT2AGABRA1 | |
| SCHEMBL791993 | 0.68 | CCR1 (0.44) | OPRM1MEN1OPRD1KMT2AGABRA1 | |
| SCHEMBL2651533 | 0.67 | GLA (0.42) | CTSAOPRM1ESR1SMN1; SMN2KCNH2 | |
| SCHEMBL6822761 | 0.67 | NOS3 (0.45) | OPRM1MEN1OPRD1KMT2AGABRA1 | |
| SCHEMBL5924102 | 0.66 | SMN1; SMN2 (0.41) | OPRM1MEN1OPRD1KMT2AGABRA1 |
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 |