Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 4/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7942184 | 0.98 | ADRA2A (0.56) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| SCHEMBL8416210 | 0.78 | KDM4E (0.54) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL8391039 | 0.77 | TSHR (0.53) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL8390599 | 0.76 | KDM4E (0.57) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| SCHEMBL320037 | 0.75 | ALDH1A1 (0.61) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| SCHEMBL23518346 | 0.74 | ALDH1A1 (0.54) | CYP3A4ALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL8390634 | 0.73 | SLC9A1 (0.53) | HTR2BSLC9A1HTR7 | |
| SCHEMBL29008206 | 0.73 | ALDH1A1 (0.58) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| SCHEMBL7754721 | 0.71 | ALDH1A1 (0.50) | HTR2BADRA2AMEN1LMNACYP3A4 | |
| SCHEMBL11349430 | 0.71 | ALDH1A1 (0.45) | LMNACYP3A4CYP2C9MAPK1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| JP-10081662-A | — | — | None | — | — | JP | disclosed |
| JP-H1081662-A | BIS-ORTHO-SUBSTITUTED BENZOYLGUANIDINE, ITS PRODUCTION, ITS USE AS MEDICINE OR DIAGNOSTIC AGENT AND MEDICINE CONTAINING THE COMPOUND | HOECHST AG | 1998-03-31 | — | — | JP | disclosed |