Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.42 |
| ▸ | PDE1A | P54750 | 1/20 | 0.42 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.42 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | UBE2N | P61088 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29490209 | 1.00 | PDE2A (0.42) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL29490334 | 0.82 | SMN1; SMN2 (0.45) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL22862649 | 0.82 | PDE2A (0.41) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL29490228 | 0.82 | PDE2A (0.41) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL22862709 | 0.78 | BRD4 (0.45) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL29490198 | 0.78 | BRD4 (0.45) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL29490219 | 0.77 | BRD4 (0.46) | PDE2APDE1APDE1BPDE1CSMN1; SMN2 | |
| SCHEMBL4855166 | 0.75 | CYP11B1 (0.58) | SMN1; SMN2HTTALDH1A1NR1I2TSHR | |
| SCHEMBL29907282 | 0.74 | L3MBTL1 (0.55) | SMN1; SMN2HTTL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL27150328 | 0.74 | L3MBTL1 (0.55) | SMN1; SMN2HTTL3MBTL1ALDH1A1KDM4E |
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-2021002986-A2 | BAX INHIBITORS AND USES THEREOF | CASE WESTERN RESERVE UNIVERSITY (US) | 2021-01-07 | — | — | WO | disclosed |