Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL25353488 | 1.00 | CYP2D6 (0.46) | CYP2D6SMN1; SMN2ALDH1A1NPSR1KDM4E | |
| SCHEMBL25353494 | 1.00 | CYP2D6 (0.46) | CYP2D6SMN1; SMN2ALDH1A1NPSR1KDM4E | |
| SCHEMBL25240487 | 0.86 | DRD4 (0.39) | CYP2D6SMN1; SMN2ALDH1A1NPSR1KDM4E | |
| SCHEMBL25640465 | 0.85 | CYP2D6 (0.48) | CYP2D6SMN1; SMN2ALDH1A1KDM4ETSHR | |
| SCHEMBL30454084 | 0.83 | DRD4 (0.41) | ALDH1A1ADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL30453495 | 0.83 | DRD4 (0.41) | ALDH1A1ADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL25353198 | 0.83 | DRD4 (0.41) | ALDH1A1ADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL25285176 | 0.83 | DRD4 (0.41) | ALDH1A1ADRA1DADRA1AADRA1BDRD4 | |
| SCHEMBL25354844 | 0.81 | MEN1 (0.48) | ADRA1DADRA1AADRA1BMAPK1MEN1 | |
| SCHEMBL25354841 | 0.81 | MEN1 (0.48) | ADRA1DADRA1AADRA1BMAPK1MEN1 |
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-2023122000-A1 | BCL-2 INHIBITORS | NEWAVE PHARMACEUTICAL INC. (US) | 2023-06-29 | — | — | WO | disclosed |