Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BUB1 | O43683 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | COMT | P21964 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.30 |
| ▸ | CMA1 | P23946 | 1/20 | 0.30 |
| ▸ | CTRC | Q99895 | 1/20 | 0.30 |
| ▸ | PDE3B | Q13370 | 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 | |
|---|---|---|---|---|
| SCHEMBL454628 | 0.87 | SMN1; SMN2 (0.36) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL457304 | 0.84 | TDP1 (0.39) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL455164 | 0.84 | SMN1; SMN2 (0.36) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL12487741 | 0.79 | SMN1; SMN2 (0.35) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL454360 | 0.78 | HTT (0.43) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL456493 | 0.78 | CYP1A2 (0.43) | HPGDALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL16435041 | 0.76 | KMT2A (0.36) | ALDH1A1MEN1KMT2ANPC1GRIN2B | |
| SCHEMBL454465 | 0.75 | ALDH1A1 (0.37) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL455598 | 0.74 | ALDH1A1 (0.45) | HPGDSMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL455741 | 0.72 | ALDH1A1 (0.35) | HPGDSMN1; SMN2ALDH1A1KDM4EMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012033548-A2 | HERBICIDAL BIS-NITROGEN-CONTAINING OXO AND SULFONO HETEROCYCLES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-03-15 | — | — | WO | disclosed |