Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27167381 | 1.00 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL7687953 | 0.85 | ALDH1A1 (0.62) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL24315862 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL21200870 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL21979152 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL27172713 | 0.75 | ALDH1A1 (0.69) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL5540923 | 0.75 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL27167397 | 0.75 | ALDH1A1 (0.49) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL1210091 | 0.74 | ALDH1A1 (0.55) | ALDH1A1HSD17B10CASP1CASP7SMN1; SMN2 | |
| SCHEMBL8107490 | 0.74 | ALDH1A1 (0.77) | ALDH1A1HSD17B10SMN1; SMN2CYP1A2MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4334305-A1 | WDR5 INHIBITORS AND MODULATORS | Vanderbilt University (US) | 2024-03-13 | — | — | EP | disclosed |
| WO-2022236101-A1 | WDR5 INHIBITORS AND MODULATORS | VANDERBILT UNIVERSITY (US) | 2022-11-10 | — | — | WO | disclosed |
| EP-4055013-A1 | WDR5 INHIBITORS AND MODULATORS | Vanderbilt University (US) | 2022-09-14 | — | — | EP | disclosed |