Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 8/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.43 |
| ▸ | MEN1 | O00255 | 7/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8731806 | 0.76 | LMNA (0.57) | LMNAMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL7372881 | 0.75 | TP53 (0.37) | MAPTTP53 | |
| SCHEMBL7372642 | 0.73 | CES2 (0.30) | LMNAALDH1A1HTTSMN1; SMN2CYP1A2 | |
| SCHEMBL7367277 | 0.70 | MET (0.40) | LMNAMAPTALDH1A1RAB9AATM | |
| SCHEMBL2752589 | 0.69 | LMNA (0.68) | LMNAMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL7373077 | 0.66 | MEN1 (0.39) | KMT2AMEN1 | |
| SCHEMBL9891792 | 0.65 | ABL1 (0.72) | LMNAMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL9891898 | 0.65 | LMNA (0.69) | LMNAMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL7369806 | 0.64 | KMT2A (0.42) | LMNAMAPTKMT2AMEN1ALDH1A1 | |
| SCHEMBL18424368 | 0.63 | ABL1 (0.67) | LMNAMAPTKMT2AMEN1ALDH1A1 |
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-0237929-B1 | 3,5-DISUBSTITUTED PYROCATECHOL DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-06-02 | — | — | EP | disclosed |
| EP-0237929-A1 | 3,5-Disubstituted pyrocatechol derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1987-09-23 | — | — | EP | disclosed |