Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29876772 | 0.88 | LMNA (0.46) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL5775036 | 0.87 | CHRM2 (0.49) | ALDH1A1LMNAKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL1751581 | 0.86 | HDAC4 (0.44) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL29876718 | 0.84 | SIGMAR1 (0.46) | SIGMAR1ALDH1A1LMNAKMT2AHIF1A | |
| SCHEMBL1974749 | 0.81 | SIGMAR1 (0.49) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL5781730 | 0.80 | CHRM2 (0.52) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| Water SCHEMBL2512481 | 0.80 | SIGMAR1 (0.47) | SIGMAR1ALDH1A1LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL8363142 | 0.79 | CHRM5 (0.55) | — | |
| SCHEMBL1974828 | 0.78 | S1PR1 (0.49) | SIGMAR1LMNAKMT2ASMN1; SMN2S1PR1 | |
| SCHEMBL8344285 | 0.78 | ADORA1 (0.47) | SIGMAR1ALDH1A1KMT2ASMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1652839-A2 | Drug efflux pump inhibitor | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-05-03 | — | — | EP | disclosed |
| EP-1227084-B1 | DRUG DISCHARGE PUMP INHIBITORS | TRINE PHARMACEUTICALS INC (US) | 2005-12-14 | — | — | EP | disclosed |
| EP-1227084-A1 | DRUG DISCHARGE PUMP INHIBITORS | Microcide Pharmaceuticals, Inc. (US) | 2002-07-31 | — | — | EP | disclosed |