Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.39 |
| ▸ | SMO | Q99835 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5720536 | 1.00 | SMN1; SMN2 (0.54) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL5711092 | 0.83 | HTR2C (0.49) | SMN1; SMN2KDM4EALDH1A1PARP10NPC1 | |
| SCHEMBL5711093 | 0.83 | HTR2C (0.49) | SMN1; SMN2KDM4EALDH1A1PARP10NPC1 | |
| SCHEMBL23537856 | 0.76 | SMN1; SMN2 (0.58) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL9304271 | 0.76 | PARP10 (0.59) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL6977226 | 0.76 | ALDH1A1 (0.58) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL22874534 | 0.75 | PARP10 (0.66) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| Hydrochloric Acid SCHEMBL128810 | 0.75 | PARP10 (0.57) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL22967626 | 0.74 | ALDH1A1 (0.55) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 | |
| SCHEMBL14037350 | 0.73 | PARP10 (0.52) | SMN1; SMN2KDM4EALDH1A1PARP10CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6864254-B1 | Inhibitor for 20-hete-yielding enzyme | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2005-03-08 | — | — | US | disclosed |