Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 3/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3714492 | 0.95 | JAK3 (0.43) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL2713150 | 0.94 | JAK3 (0.45) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL2770958 | 0.80 | PARP1 (0.51) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL21119052 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4ESMN1; SMN2MAPT | |
| SCHEMBL7456370 | 0.77 | HSD11B1 (0.47) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL6796063 | 0.74 | PARP1 (0.49) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL8406937 | 0.74 | MAP2K1 (0.42) | ALDH1A1KDM4ETDP1KCNH2 | |
| SCHEMBL16333965 | 0.72 | DRD2 (0.43) | ALDH1A1HPGDSMN1; SMN2JAK3GMNN | |
| SCHEMBL28205963 | 0.71 | KDM4E (0.41) | PARP1ALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL3714860 | 0.71 | KCNA5 (0.49) | PARP1ALDH1A1HPGDKDM4EHSD17B10 |
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-2010129802-A1 | INHIBITORS OF JAK | PORTOLA PHARMACEUTICALS, INC. (US) | 2010-11-11 | — | — | WO | claimed |