Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.42 |
| ▸ | BCL2 | P10415 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.39 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD5 | P21918 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28009451 | 0.82 | CALM1 (0.44) | HTR2ACALM1BCL2BCL2L1CYP1A2 | |
| SCHEMBL11203718 | 0.79 | HTR2A (0.39) | HTR2ACALM1BCL2BCL2L1TP53 | |
| SCHEMBL6546758 | 0.79 | CALM1 (0.46) | HTR2ACALM1BCL2BCL2L1TP53 | |
| SCHEMBL9344584 | 0.79 | GABRA1 (0.46) | TP53L3MBTL1 | |
| SCHEMBL10782398 | 0.78 | CALM1 (0.44) | HTR2ACALM1BCL2BCL2L1TP53 | |
| SCHEMBL5764360 | 0.77 | CALM1 (0.48) | HTR2ACALM1BCL2BCL2L1DRD2 | |
| SCHEMBL29470998 | 0.76 | BCL2 (0.45) | HTR2ACALM1BCL2BCL2L1DRD2 | |
| SCHEMBL8322110 | 0.76 | HTR2A (0.47) | HTR2ACALM1BCL2BCL2L1DRD2 | |
| SCHEMBL8815094 | 0.76 | BCL2 (0.45) | HTR2ACALM1BCL2BCL2L1DRD2 | |
| SCHEMBL5380250 | 0.75 | KDM4E (0.56) | HTR2ACALM1BCL2BCL2L1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4327040-A | BASIC CATALYZED REACTION OF PROPARGYL ALCOHOL WITH A PHOSPHORIC ACID CHLORIDE | BAYER AKTIENGESELLSCHAFT (DE) | 1982-04-27 | — | — | US | disclosed |