Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24723659 | 0.82 | ALDH1A1 (0.59) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL24722773 | 0.81 | ALDH1A1 (0.45) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL14950045 | 0.80 | NPC1 (0.66) | KMT2AMEN1ALDH1A1TSHRHPGD | |
| SCHEMBL2218290 | 0.74 | KMT2A (0.59) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL8423246 | 0.73 | KMT2A (0.53) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL21078333 | 0.73 | ALDH1A1 (0.58) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL5113828 | 0.72 | ALDH1A1 (0.52) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL7054521 | 0.72 | ALDH1A1 (0.64) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL12414402 | 0.72 | ALDH1A1 (0.64) | KMT2AMEN1ALDH1A1TSHRMAPK1 | |
| SCHEMBL384906 | 0.72 | ALDH1A1 (0.64) | KMT2AMEN1ALDH1A1TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022166920-A1 | PYRROLOPYRIDAZINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 杭州中美华东制药有限公司 | 2022-08-11 | — | — | WO | 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 |