Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ5 | P48544 | 1/20 | 0.36 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KHK | P50053 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | CASP7 | P55210 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | NSD2 | O96028 | 1/20 | 0.30 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.30 |
| ▸ | CSF1R | P07333 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28499600 | 0.89 | ALDH1A1 (0.39) | KCNJ5KCNJ3LMNAALDH1A1HTR7 | |
| SCHEMBL427905 | 0.82 | LMNA (0.45) | LMNAALDH1A1KHKHTR7GAA | |
| SCHEMBL28509585 | 0.78 | ALDH1A1 (0.33) | ALDH1A1GAAMEN1KMT2A | |
| SCHEMBL28504600 | 0.77 | LMNA (0.39) | KCNJ5KCNJ3LMNAALDH1A1KHK | |
| SCHEMBL28499619 | 0.77 | DRD4 (0.40) | KCNJ5KCNJ3LMNAALDH1A1KHK | |
| SCHEMBL28502440 | 0.74 | GAA (0.54) | LMNAALDH1A1GAAMEN1KMT2A | |
| SCHEMBL428655 | 0.74 | ROCK1 (0.34) | ALDH1A1MEN1KMT2AKDM4ETSHR | |
| SCHEMBL24723411 | 0.73 | LPL (0.33) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL586151 | 0.71 | LPL (0.41) | ALDH1A1GAAMEN1KMT2AKDM4E | |
| SCHEMBL18621693 | 0.70 | DRD2 (0.45) | DRD2DRD3 |
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-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |