Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | RGS12 | O14924 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4231741 | 0.74 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2HTTTRPA1KMT2A | |
| SCHEMBL22307393 | 0.73 | KMT2A (0.49) | ALDH1A1HTTKMT2AGAARAB9A | |
| SCHEMBL11299688 | 0.69 | GAA (0.49) | ALDH1A1SMN1; SMN2TRPA1KMT2AGAA | |
| SCHEMBL10620702 | 0.69 | TRPA1 (0.32) | TRPA1 | |
| SCHEMBL11548862 | 0.69 | MERTK (0.43) | ALDH1A1SMN1; SMN2KMT2ARAB9AKDM4E | |
| SCHEMBL7529082 | 0.67 | MAOB (0.40) | ALDH1A1MAPK1MAPTNPSR1HPGD | |
| SCHEMBL5542704 | 0.67 | HPGD (0.36) | ALDH1A1KMT2AMAPK1MAPTMEN1 | |
| SCHEMBL10620530 | 0.67 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2HTTKMT2AKDM4E | |
| SCHEMBL10616544 | 0.66 | GABRA1 (0.44) | ALDH1A1SMN1; SMN2HTTKMT2AGAA | |
| SCHEMBL10620705 | 0.66 | CYP3A4 (0.32) | TRPA1MAPK1HPGDTSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4151298-A | ANILINOMETHYLENEMALONONITRILE DERIVATIVES | CIBA-GEIGY CORPORATION (US) | 1979-04-24 | — | — | US | disclosed |