Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | KDM1A | O60341 | 5/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.35 |
| ▸ | CPT2 | P23786 | 1/20 | 0.35 |
| ▸ | CPT1A | P50416 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 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 | |
|---|---|---|---|---|
| SCHEMBL21930565 | 0.81 | SIGMAR1 (0.42) | SIGMAR1KDM1ABACE1KDM4CESR1 | |
| SCHEMBL21993938 | 0.81 | SIGMAR1 (0.47) | SIGMAR1KDM1ABACE1KDM4CDRD2 | |
| SCHEMBL21998382 | 0.81 | SIGMAR1 (0.47) | SIGMAR1KDM1ABACE1KDM4CDRD2 | |
| SCHEMBL21930213 | 0.81 | SIGMAR1 (0.42) | SIGMAR1KDM1ABACE1KDM4CESR1 | |
| SCHEMBL23442097 | 0.78 | KDM1A (0.41) | SIGMAR1KDM1ABACE1KDM4C | |
| SCHEMBL24461725 | 0.77 | KDM1A (0.39) | SIGMAR1KDM1ABACE1KDM4C | |
| SCHEMBL23442626 | 0.77 | KDM1A (0.41) | SIGMAR1KDM1AKDM4CALDH1A1RAB9A | |
| SCHEMBL24461876 | 0.77 | KDM1A (0.39) | SIGMAR1KDM1ABACE1LMNA | |
| SCHEMBL29554154 | 0.75 | KMT2A (0.40) | SIGMAR1KDM4CALDH1A1RAB9ANPC1 | |
| SCHEMBL25813884 | 0.75 | KDM1A (0.35) | SIGMAR1KDM1AALDH1A1LMNARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-115698024-A | Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia 1 (MCL-1) protein | 普莱鲁德疗法有限公司 | 2023-02-03 | — | — | CN | disclosed |