Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.49 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.49 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.49 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.49 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.49 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11715405 | 0.88 | KDM4E (0.52) | SMN1; SMN2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL4360418 | 0.85 | LMNA (0.51) | SMN1; SMN2ALDH1A1LMNAKDM4ETSHR | |
| Hypochlorous Acid SCHEMBL9144744 | 0.84 | KDM4E (0.49) | SMN1; SMN2PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5102530 | 0.84 | CYP2D6 (0.59) | SMN1; SMN2ALDH1A1LMNAKDM4EHTR2C | |
| SCHEMBL1154092 | 0.83 | KDM4E (0.54) | SMN1; SMN2ALDH1A1LMNAKDM4EHTT | |
| SCHEMBL2799514 | 0.82 | MAPT (0.55) | SMN1; SMN2ALDH1A1LMNAKDM4EHTT | |
| SCHEMBL6421995 | 0.82 | SLC6A4 (0.51) | SMN1; SMN2ALDH1A1LMNAKDM4EHTT | |
| SCHEMBL929622 | 0.82 | MAPT (0.50) | SMN1; SMN2ALDH1A1LMNAKDM4EHTT | |
| SCHEMBL1505120 | 0.82 | S1PR4 (0.52) | ALDH1A1LMNAKDM4EHPGDMAPT | |
| SCHEMBL17040919 | 0.82 | SMN1; SMN2 (0.58) | SMN1; SMN2ALDH1A1LMNAHTTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-54119428-A | — | — | None | — | — | JP | disclosed |
| JP-S54119428-A | NOVEL BENZOIC ACID DERIVATIVE | HISAMITSU PHARMACEUT CO INC | 1979-09-17 | — | — | JP | disclosed |