Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | OXTR | P30559 | 2/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | EED | O75530 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.34 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | SLC2A2 | P11168 | 1/20 | 0.33 |
| ▸ | SLC2A3 | P11169 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22858909 | 1.00 | NPC1 (0.41) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL22858726 | 0.84 | NSD2 (0.50) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL22922380 | 0.84 | NSD2 (0.50) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL22858730 | 0.84 | NSD2 (0.50) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL22858733 | 0.79 | NPC1 (0.38) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL22858734 | 0.79 | NPC1 (0.38) | NPC1GAARAB9AKMT2ANSD2 | |
| SCHEMBL25013007 | 0.78 | NPC1 (0.47) | NPC1GAARAB9AKMT2AOXTR | |
| Hydrochloric Acid SCHEMBL14721951 | 0.78 | USP30 (0.45) | KMT2A | |
| SCHEMBL22858742 | 0.77 | CNR2 (0.46) | NPC1RAB9AKMT2ACNR2HPGD | |
| SCHEMBL22858744 | 0.77 | CNR2 (0.46) | NPC1RAB9AKMT2ACNR2HPGD |
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-2021013083-A1 | TRICYCLIC COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2021-01-28 | — | — | WO | disclosed |
| WO-2021000925-A1 | PYRROLO [2, 3-b] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2021-01-07 | — | — | WO | disclosed |