Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.45 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.45 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.45 |
| ▸ | NPY2R | P49146 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL26621555 | 1.00 | ALDH1A1 (0.51) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL26621558 | 1.00 | ALDH1A1 (0.51) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL28833794 | 1.00 | ALDH1A1 (0.51) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL16765456 | 0.91 | ALDH1A1 (0.51) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL13039150 | 0.88 | ALDH1A1 (0.47) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL3333844 | 0.88 | GPR119 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL1219498 | 0.88 | GPR119 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL21197779 | 0.88 | GPR119 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL19814665 | 0.88 | GPR119 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR | |
| SCHEMBL1218706 | 0.88 | GPR119 (0.48) | ALDH1A1KDM4ESMN1; SMN2HPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-114980976-A | Covalent RAS inhibitors and uses thereof | 锐新医药公司 | 2022-08-30 | — | — | CN | disclosed |