Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | ACHE | P22303 | 3/20 | 0.50 |
| ▸ | CETP | P11597 | 1/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL659321 | 0.85 | SMN1; SMN2 (0.63) | SMN1; SMN2KDM4EHPGDNPC1RAB9A | |
| SCHEMBL28658857 | 0.84 | NPC1 (0.70) | SMN1; SMN2KDM4EHPGDNPC1RAB9A | |
| SCHEMBL13386260 | 0.81 | SMN1; SMN2 (0.55) | SMN1; SMN2KDM4EHPGDNPC1RAB9A | |
| SCHEMBL3859947 | 0.81 | ALOX5 (0.67) | HTR1ACYP1A2CYP3A4MAPTCYP2C19 | |
| SCHEMBL30834904 | 0.81 | CYP19A1 (0.61) | CYP19A1ACHECYP1A2CYP3A4LMNA | |
| SCHEMBL10455943 | 0.80 | CTNNB1 (0.66) | SMN1; SMN2KDM4EHPGDNPC1RAB9A | |
| SCHEMBL29066089 | 0.79 | TUBB1 (0.67) | CYP19A1CYP1A2CYP3A4LMNATSHR | |
| SCHEMBL30504067 | 0.79 | TUBB1 (0.67) | CYP19A1CYP1A2CYP3A4LMNATSHR | |
| SCHEMBL10328456 | 0.79 | CYP19A1 (0.65) | CYP19A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL10252865 | 0.79 | NPC1 (0.51) | SMN1; SMN2KDM4EHPGDNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0297435-B1 | AMINOPROPANOL DERIVATIVES OF 3-(3'-HYDROXYPHENYL)-1-PROPANONE, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS | Helopharm W. Petrik GmbH & Co.KG. (DE) | 1991-10-16 | — | — | EP | disclosed |
| EP-0297435-A2 | Aminopropanol derivatives of 3-(3'-hydroxyphenyl)-1-propanone, process for their preparation and medicines containing these compounds | Helopharm W. Petrik GmbH & Co.KG. (DE) | 1989-01-04 | — | — | EP | disclosed |