Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 2/20 | 0.39 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL2652551 | 0.83 | FFAR1 (0.41) | ALDH1A1TSHRMAOBCYP19A1KMT2A | |
| SCHEMBL2652111 | 0.80 | IDO1 (0.41) | ALDH1A1TSHRMAOBSGMS2SMN1; SMN2 | |
| SCHEMBL2652007 | 0.79 | TSHR (0.43) | ALDH1A1TSHRMAOBLMNA | |
| SCHEMBL2651003 | 0.79 | IDO1 (0.40) | ALDH1A1POLBHTTMAOBKMT2A | |
| SCHEMBL2652010 | 0.79 | IDO1 (0.40) | MAOBKMT2A | |
| SCHEMBL27641953 | 0.76 | ALDH1A1 (0.50) | ALDH1A1HPGDPOLBHTTTSHR | |
| SCHEMBL2651078 | 0.75 | IDO1 (0.44) | ALDH1A1HTTMAOBSMN1; SMN2 | |
| SCHEMBL2650110 | 0.75 | TP53 (0.41) | ALDH1A1HTTTSHRMAOBSGMS2 | |
| SCHEMBL11505765 | 0.74 | ALDH1A1 (0.56) | ALDH1A1HPGDPOLBHTTTSHR | |
| SCHEMBL11062072 | 0.71 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTTSHRMAOB |
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 |