Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD5 | P21918 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MCOLN2 | Q8IZK6 | 1/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.42 |
| ▸ | MCOLN1 | Q9GZU1 | 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 | |
|---|---|---|---|---|
| SCHEMBL29501323 | 0.89 | SLC18A3 (0.44) | SLC18A3KEAP1NOTUMMEN1MAPT | |
| SCHEMBL30443755 | 0.81 | PRMT5 (0.52) | DRD2TP53 | |
| SCHEMBL28999493 | 0.81 | PRMT5 (0.52) | DRD2TP53 | |
| SCHEMBL2925583 | 0.81 | ADRA1A (0.53) | SLC18A3KEAP1NOTUMADRA1AKCNH2 | |
| SCHEMBL28612826 | 0.77 | ADRA1A (0.54) | SLC18A3KEAP1ADRA1AKCNH2HRH3 | |
| SCHEMBL322928 | 0.77 | NOTUM (0.70) | KEAP1NOTUMMEN1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL21496871 | 0.75 | NOTUM (0.68) | KEAP1NOTUMMEN1MAPTKMT2A | |
| SCHEMBL2933131 | 0.74 | HRH3 (0.55) | KMT2AKDM4ESMN1; SMN2ADRA1AKCNH2 | |
| SCHEMBL23114040 | 0.74 | RIPK1 (0.66) | KEAP1NOTUMMEN1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL28278641 | 0.74 | NOTUM (0.66) | KEAP1NOTUMMEN1MAPTKMT2A |
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-2022048631-A1 | COMPOUND HAVING ANTITUMOR ACTIVITY AND USE THEREOF | 上海翊石医药科技有限公司 | 2022-03-10 | — | — | WO | disclosed |