Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.67 |
| ▸ | RAB9A | P51151 | 2/20 | 0.67 |
| ▸ | NPC1 | O15118 | 1/20 | 0.67 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | HPGD | P15428 | 5/20 | 0.61 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.60 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.55 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL12653723 | 0.87 | SMN1; SMN2 (0.52) | SMN1; SMN2RAB9ANPC1EPHX1MEN1 | |
| SCHEMBL9808765 | 0.84 | EPHX2 (0.65) | RAB9ANPC1EPHX1MEN1KMT2A | |
| SCHEMBL2976977 | 0.84 | EPHX2 (0.65) | RAB9ANPC1EPHX1MEN1KMT2A | |
| SCHEMBL6336112 | 0.82 | ERCC1 (0.69) | SMN1; SMN2RAB9ANPC1HPGDTRPV1 | |
| SCHEMBL9425620 | 0.81 | ALOX5 (0.60) | EPHX1MEN1KMT2AHPGDKDM4E | |
| SCHEMBL4979498 | 0.80 | ALDH1A1 (0.63) | SMN1; SMN2RAB9ANPC1EPHX1MEN1 | |
| SCHEMBL12653724 | 0.79 | TRPV1 (0.53) | SMN1; SMN2RAB9ANPC1EPHX1MEN1 | |
| SCHEMBL12196157 | 0.78 | EPHX1 (1.00) | SMN1; SMN2RAB9ANPC1EPHX1MEN1 | |
| SCHEMBL4015274 | 0.78 | ALDH1A1 (0.60) | SMN1; SMN2RAB9ANPC1EPHX1MEN1 | |
| SCHEMBL2960830 | 0.77 | EPHX2 (0.56) | RAB9ANPC1EPHX1MEN1KMT2A |
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-1402887-A1 | New compounds for the inhibition of undesired cell proliferation and use thereof | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |
| EP-1402888-A1 | The use of substituted carbocyclic compounds as rotamases inhibitors | Jerini AG (DE) | 2004-03-31 | — | — | EP | claimed |