Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 7/20 | 0.55 |
| ▸ | TNIK | Q9UKE5 | 6/20 | 0.53 |
| ▸ | MAP3K11 | Q16584 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.44 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.44 |
| ▸ | IL2 | P60568 | 2/20 | 0.44 |
| ▸ | SGK1 | O00141 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21592605 | 0.97 | MAP4K1 (0.58) | MAP4K1TNIKMAP3K11CYP3A4CYP1A2 | |
| SCHEMBL21592685 | 0.91 | MAP3K11 (0.47) | MAP4K1TNIKMAP3K11ROCK2ROCK1 | |
| SCHEMBL28502217 | 0.90 | MAP4K1 (0.59) | MAP4K1TNIKMAP3K11CYP3A4CYP1A2 | |
| SCHEMBL21592875 | 0.89 | MAP4K1 (0.56) | MAP4K1TNIKMAP3K11CYP3A4CYP1A2 | |
| SCHEMBL21592598 | 0.89 | MAP4K1 (0.56) | MAP4K1TNIKMAP3K11CYP3A4CYP1A2 | |
| SCHEMBL28905284 | 0.88 | SGK1 (0.57) | MAP4K1TNIKMAP3K11IL2SGK1 | |
| SCHEMBL21592556 | 0.87 | MAP4K1 (0.62) | MAP4K1TNIKMAP3K11 | |
| SCHEMBL21592821 | 0.86 | TNIK (0.55) | MAP4K1TNIKMAP3K11IL2 | |
| SCHEMBL28503521 | 0.86 | TNIK (0.53) | MAP4K1TNIKMAP3K11ROCK2ROCK1 | |
| SCHEMBL28507510 | 0.86 | MAP4K1 (0.53) | MAP4K1TNIKMAP3K11CYP3A4CYP1A2 |
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-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |