Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 1/20 | 0.45 |
| ▸ | HRH2 | P25021 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
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 SCHEMBL9778507 | 0.99 | MEN1 (0.48) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL9778437 | 0.92 | FAAH (0.44) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL9778450 | 0.89 | DRD2 (0.49) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL10414807 | 0.85 | CNR1 (0.46) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL10414870 | 0.83 | HTR1A (0.48) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL9778524 | 0.82 | HTR2A (0.44) | SMN1; SMN2HTR1AHTR2AHTR7DRD3 | |
| SCHEMBL13153696 | 0.81 | DRD3 (0.48) | FAAHCYP3A4CYP2D6TSHRALOX12 | |
| SCHEMBL7722771 | 0.80 | HTR2A (0.43) | MAPK1KMT2ASMN1; SMN2HTR1AHTR2A | |
| SCHEMBL1544905 | 0.79 | ADRA1D (0.49) | HTR1AADRA1DHTR2AHTR7ADRA1A | |
| SCHEMBL27263489 | 0.78 | DRD4 (0.49) | HTR1ADRD4HTR7DRD3SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4954503-A | ANALGESIC, ANTIPSYCHOTIC AGENTS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1990-09-04 | — | — | US | claimed |
| US-5077405-A | Condensation of corresponding phenylsulfonyl compound with condensation agent, cyanation, reduction | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-12-31 | — | — | US | disclosed |
| US-4954503-A | ANALGESIC, ANTIPSYCHOTIC AGENTS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1990-09-04 | — | — | US | disclosed |