Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NAE1 | Q13564 | 1/20 | 0.36 |
| ▸ | UBA3 | Q8TBC4 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL415622 | 0.82 | CALM1 (0.50) | HTR2BALDH1A1MAOBCALM1RAB9A | |
| SCHEMBL27561291 | 0.79 | AR (0.35) | ALDH1A1KDM4EMEN1HPGDKMT2A | |
| SCHEMBL24348809 | 0.74 | HTR2B (0.41) | HTR2BALDH1A1HPGDMAOBCALM1 | |
| SCHEMBL3913251 | 0.74 | ALDH1A1 (0.52) | HTR2BALDH1A1MEN1HPGDKMT2A | |
| SCHEMBL20348519 | 0.74 | LOXL2 (0.43) | HTR2BALDH1A1MAOBCALM1RAB9A | |
| SCHEMBL3923373 | 0.74 | BCL2 (0.44) | HTR2BALDH1A1MEN1HPGDKMT2A | |
| SCHEMBL23020320 | 0.73 | MIF (0.52) | HTR2BALDH1A1KDM4EMEN1HPGD | |
| SCHEMBL27561290 | 0.72 | HRH4 (0.47) | ALDH1A1KDM4EHPGDRAB9APOLB | |
| SCHEMBL23036046 | 0.71 | MAOB (0.46) | HTR2BALDH1A1KDM4EMAOBCALM1 | |
| SCHEMBL304034 | 0.71 | ALDH1A1 (0.41) | ALDH1A1KDM4EMEN1HPGDKMT2A |
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-1371367-A | Phenethyl-5-bromopyridylthiourea (PBT) and Dihydroalkoxybenzyloxopyrimidine (DABO) derivatives exhibiting spermicidal activity | PARKER HUGHES INST (US) | 2002-09-25 | — | — | CN | disclosed |