Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 6/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28569262 | 0.80 | ESR2 (0.44) | ESR2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL5615371 | 0.72 | — | — | |
| SCHEMBL30549518 | 0.71 | APP (0.44) | ESR2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL13900902 | 0.71 | ALDH1A1 (0.37) | HPGDALDH1A1NPC1 | |
| Hydrochloric Acid SCHEMBL21412324 | 0.70 | APP (0.43) | ESR2MAPTMEN1KMT2AKDM4E | |
| SCHEMBL29533363 | 0.70 | HTR2C (0.35) | MAPTHPGDALDH1A1NPC1RAB9A | |
| SCHEMBL12147023 | 0.70 | PARP1 (0.34) | — | |
| SCHEMBL15329424 | 0.69 | — | — | |
| SCHEMBL30643452 | 0.69 | KCNH2 (0.35) | MAPTMEN1KMT2AKDM4EHPGD | |
| SCHEMBL15167504 | 0.69 | IRAK4 (0.45) | KDM4EHPGDALDH1A1SMN1; SMN2HSD17B10 |
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-112661751-B | Heterocyclic compounds as BCL-2 inhibitors | 南京天印健华医药科技有限公司 | 2024-06-14 | — | — | CN | disclosed |
| CN-112661751-A | Heterocyclic compounds as BCL-2 inhibitors | 南京天印健华医药科技有限公司 | 2021-04-16 | — | — | CN | disclosed |