Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | HPGD | P15428 | 6/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12701772 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL30762625 | 0.78 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL30762528 | 0.78 | KMT2A (0.55) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL30762666 | 0.74 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL17531163 | 0.72 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL14573270 | 0.72 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4ESMN1; SMN2HTT | |
| SCHEMBL29193671 | 0.71 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EGAAHTT | |
| SCHEMBL11753128 | 0.70 | ALDH1A1 (0.76) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL24195087 | 0.69 | ALDH1A1 (0.48) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 | |
| SCHEMBL4658327 | 0.69 | ALDH1A1 (0.52) | ALDH1A1HPGDKDM4EGAASMN1; SMN2 |
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-2024026423-A1 | SUBSTITUTED QUINOLINE DERIVATIVES AS PI3K INHIBITORS | BLACK DIAMOND THERAPEUTICS, INC. (US) | 2024-02-01 | — | — | WO | disclosed |