Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 5/20 | 0.32 |
| ▸ | MAOB | P27338 | 3/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.32 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17845590 | 0.83 | SMN1; SMN2 (0.40) | ALDH1A1LMNASMN1; SMN2GAA | |
| SCHEMBL17845711 | 0.83 | ALDH1A1 (0.35) | ALDH1A1GAAKDM1A | |
| SCHEMBL17845643 | 0.82 | KMT2A (0.37) | ALDH1A1LMNAKDM1AMAOBMAOA | |
| SCHEMBL17845626 | 0.82 | FADS1 (0.42) | ALDH1A1LMNAGAACYP1A2CYP3A4 | |
| SCHEMBL17845717 | 0.80 | MAPK1 (0.39) | ALDH1A1SMN1; SMN2GAAKDM1AMAOB | |
| SCHEMBL17845760 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2GAADDB1 | |
| SCHEMBL17845600 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2GAADDB1 | |
| SCHEMBL17845540 | 0.78 | RAB9A (0.43) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL17845563 | 0.78 | ALDH1A1 (0.34) | ALDH1A1LMNASMN1; SMN2GAAKDM1A | |
| SCHEMBL17845666 | 0.78 | GAA (0.37) | ALDH1A1SMN1; SMN2GAAKDM1ADDB1 |
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-3233860-A1 | SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS | Univerzita Palackého V Olomouci (CZ) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016095881-A1 | SUBSTITUTED 6-ANILINO-9-HETEROCYCLYLPURINE DERIVATIVES FOR INHIBITION OF PLANT STRESS | UNIVERZITA PALACKEHO V OLOMOUCI (CZ) | 2016-06-23 | — | — | WO | disclosed |