Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19062011 | 0.86 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19061947 | 0.84 | P2RX7 (0.44) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL22263119 | 0.83 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19019923 | 0.80 | GAA (0.43) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19061459 | 0.78 | RAB9A (0.46) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19019875 | 0.77 | TRPV6 (0.45) | ALDH1A1SMN1; SMN2HTTDRD2DRD3 | |
| SCHEMBL19061588 | 0.76 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19061954 | 0.72 | HSD17B10 (0.42) | ALDH1A1SMN1; SMN2KMT2AMEN1HSD17B10 | |
| SCHEMBL19061438 | 0.71 | ALDH1A1 (0.43) | ALDH1A1KMT2AMEN1TSHRHTT | |
| SCHEMBL19061440 | 0.71 | MAPK1 (0.46) | ALDH1A1SMN1; SMN2HTTMAPK1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3184514-A1 | AUTOPHAGY INHIBITORS | Deutsches Krebsforschungszentrum (DE) | 2017-06-28 | — | — | EP | disclosed |