Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | TGM2 | P21980 | 2/20 | 0.36 |
| ▸ | F13A1 | P00488 | 1/20 | 0.36 |
| ▸ | TGM1 | P22735 | 1/20 | 0.36 |
| ▸ | TGM3 | Q08188 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | STAT1 | P42224 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3567880 | 0.86 | SMN1; SMN2 (0.49) | CYP2C19SMN1; SMN2LMNATGM2F13A1 | |
| SCHEMBL6389932 | 0.82 | SMN1; SMN2 (0.49) | CYP2C19SMN1; SMN2ATML3MBTL1KDM4E | |
| SCHEMBL1978925 | 0.72 | CYP1A2 (0.42) | CYP2C19SMN1; SMN2CNR1CYP1A2ALDH1A1 | |
| SCHEMBL323957 | 0.71 | ADRB2 (0.56) | SMN1; SMN2ATML3MBTL1HTTCNR1 | |
| SCHEMBL24325919 | 0.69 | SMN1; SMN2 (0.69) | CYP2C19SMN1; SMN2ATML3MBTL1RAB9A | |
| SCHEMBL2290184 | 0.69 | KDM4E (0.44) | CYP2C19SMN1; SMN2LMNATGM2F13A1 | |
| SCHEMBL2291816 | 0.69 | KDM4E (0.44) | CYP2C19SMN1; SMN2LMNATGM2F13A1 | |
| SCHEMBL1554805 | 0.68 | CYP1A2 (0.47) | CYP2C19SMN1; SMN2CNR1CYP1A2MEN1 | |
| SCHEMBL17710307 | 0.68 | CYP1A2 (0.47) | CYP2C19SMN1; SMN2CNR1CYP1A2MEN1 | |
| Hydrochloric Acid SCHEMBL18553838 | 0.68 | SMN1; SMN2 (0.45) | CYP2C19SMN1; SMN2LMNAATML3MBTL1 |
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-3600286-A1 | COMPOUNDS AND METHODS FOR THE TREATMENT OF PARASITIC DISEASES | The Broad Institute, Inc. (US) | 2020-02-05 | — | — | EP | disclosed |
| WO-2018175385-A1 | COMPOUNDS AND METHODS FOR THE TREATMENT OF PARASITIC DISEASES | THE BROAD INSTITUTE, INC. (US) | 2018-09-27 | — | — | WO | disclosed |