Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | MAOB | P27338 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 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 | 0.84 | SMN1; SMN2 (0.40) | POLBTRPA1RAB9AALDH1A1NPC1 | |
| SCHEMBL17845711 | 0.84 | ALDH1A1 (0.35) | KDM1AALDH1A1 | |
| SCHEMBL17845669 | 0.83 | ALDH1A1 (0.40) | DDB1CRBNKDM1AMAOBALDH1A1 | |
| SCHEMBL17845778 | 0.82 | DDB1 (0.36) | DDB1CRBNPOLBTRPA1ESR1 | |
| SCHEMBL17845763 | 0.82 | KDM4E (0.41) | TRPA1KDM1ARAB9AMAOBNPC1 | |
| SCHEMBL17845696 | 0.81 | DDB1 (0.35) | DDB1CRBNPOLBTRPA1ESR1 | |
| SCHEMBL17845717 | 0.80 | MAPK1 (0.39) | POLBKDM1ARAB9AMAOBALDH1A1 | |
| SCHEMBL17845751 | 0.77 | ALDH1A1 (0.47) | RAB9AALDH1A1NPC1LMNA | |
| SCHEMBL17845666 | 0.75 | GAA (0.37) | DDB1CRBNPOLBKDM1ARAB9A | |
| SCHEMBL17845643 | 0.73 | KMT2A (0.37) | KDM1AMAOBALDH1A1NPC1MAOA |
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 |