Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17845650 | 0.82 | FADS1 (0.50) | KMT2ACYP3A4TSHRDDB1CRBN | |
| SCHEMBL17845578 | 0.82 | TSHR (0.39) | KMT2ACYP3A4TSHRALDH1A1CYP1A2 | |
| SCHEMBL17845508 | 0.82 | CYP3A4 (0.39) | KMT2ACYP3A4TSHRALDH1A1CYP1A2 | |
| SCHEMBL17845575 | 0.82 | KDM4E (0.43) | KMT2ADDB1CRBNNPC1MEN1 | |
| SCHEMBL17845490 | 0.79 | ROCK2 (0.49) | KMT2ACYP3A4ALDH1A1NPC1MEN1 | |
| SCHEMBL17845466 | 0.74 | ALDH1A1 (0.42) | KMT2AALDH1A1NPC1MEN1HTT | |
| SCHEMBL17845623 | 0.71 | DDB1 (0.47) | KMT2ACYP3A4DDB1CRBNALDH1A1 | |
| SCHEMBL17845604 | 0.69 | GAA (0.47) | KMT2ATSHRALDH1A1NPC1CA1 | |
| SCHEMBL126258 | 0.68 | CYP3A4 (0.47) | KMT2ACYP3A4TSHRALDH1A1CYP1A2 | |
| SCHEMBL17845643 | 0.68 | KMT2A (0.37) | KMT2ACYP3A4TSHRALDH1A1CYP1A2 |
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 |