Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.49 |
| ▸ | SGK1 | O00141 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL21590270 | 0.92 | CA1 (0.53) | CA1CA2FKBP1ASGK1TGM2 | |
| SCHEMBL5748547 | 0.84 | CA1 (0.46) | CA1CA2FKBP1ASGK1BRD4 | |
| SCHEMBL17404466 | 0.81 | BRD4 (0.51) | CA1CA2SGK1BRD4BRPF1 | |
| SCHEMBL4319262 | 0.80 | ALDH1A1 (0.55) | CA1CA2FKBP1ASGK1BRD4 | |
| SCHEMBL10650094 | 0.79 | BRD4 (0.52) | CA1CA2SGK1BRD4BRPF1 | |
| SCHEMBL1267272 | 0.78 | SGK1 (0.43) | SGK1BRD4BRPF1HDAC4MAP2K4 | |
| SCHEMBL8091184 | 0.77 | RAB9A (0.57) | CA1CA2NPC1RAB9AKMT2A | |
| SCHEMBL20946432 | 0.76 | SGK1 (0.48) | CA1CA2SGK1BRD4BRPF1 | |
| SCHEMBL8264979 | 0.76 | KMT2A (0.48) | CA1CA2SGK1BRD4BRPF1 | |
| SCHEMBL27396497 | 0.76 | EPHX1 (0.49) | SGK1BRD4BRPF1HTTMAP2K4 |
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 2 patents. 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 |
| 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 |