Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.54 |
| ▸ | TBXA2R | P21731 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6947048 | 0.93 | SLC6A4 (0.58) | SLC6A4TBXA2RTP53KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL6950832 | 0.92 | SLC6A4 (0.57) | SLC6A4TBXA2RTP53KDM4ETSHR | |
| Fumaric Acid SCHEMBL8670305 | 0.92 | TBXA2R (0.47) | SLC6A4TBXA2RKDM4EALDH1A1TBXAS1 | |
| Fumaric Acid SCHEMBL8670308 | 0.92 | TBXA2R (0.47) | SLC6A4TBXA2RKDM4EALDH1A1TBXAS1 | |
| SCHEMBL6946854 | 0.88 | SLC6A4 (0.54) | SLC6A4TBXA2RTBXAS1CYP3A4CYP2D6 | |
| SCHEMBL6950410 | 0.88 | TBXA2R (0.58) | TBXA2RTBXAS1CYP19A1 | |
| Hydrochloric Acid SCHEMBL8666242 | 0.87 | SLC6A4 (0.53) | SLC6A4TBXA2RTBXAS1CYP3A4CYP2D6 | |
| SCHEMBL6943201 | 0.86 | MEN1 (0.50) | SLC6A4TBXA2RTSHRALDH1A1TBXAS1 | |
| SCHEMBL6948590 | 0.85 | CYP1A2 (0.56) | SLC6A4TBXA2RTBXAS1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL6949500 | 0.84 | CYP1A2 (0.55) | SLC6A4TBXA2RTBXAS1CYP3A4CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0709378-B1 | Aminoalkyloximes, a process for their preparation, their use as medicaments and intermediate compounds | AVENTIS PHARMA INC (US) | 2003-03-19 | — | — | EP | claimed |
| US-5696142-A | TREATING DEPRESSION, OBSESSIVE COMPULSIVE DISORDERS | HOECHST MARION ROUSSEL, INC. (US) | 1997-12-09 | — | — | US | claimed |
| EP-0709378-A2 | Aminoalkyloximes, a process for their preparation, their use as medicaments and intermediate compounds | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1996-05-01 | — | — | EP | claimed |
| EP-0709378-B1 | Aminoalkyloximes, a process for their preparation, their use as medicaments and intermediate compounds | AVENTIS PHARMA INC (US) | 2003-03-19 | — | — | EP | disclosed |
| EP-0709378-A2 | Aminoalkyloximes, a process for their preparation, their use as medicaments and intermediate compounds | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1996-05-01 | — | — | EP | disclosed |