Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6568635 | 0.88 | MEN1 (0.55) | HPGDMEN1KMT2APOLBALDH1A1 | |
| SCHEMBL8880319 | 0.84 | L3MBTL1 (0.59) | HPGDMEN1KMT2ATSHRPKM | |
| SCHEMBL11428782 | 0.83 | CYP3A4 (0.67) | HPGDMEN1KMT2ATSHRPOLB | |
| SCHEMBL3106393 | 0.82 | KDM4E (0.57) | HPGDMEN1KMT2ATSHRPOLB | |
| SCHEMBL10039553 | 0.82 | HPGD (0.70) | HPGDMEN1KMT2ATSHRPOLB | |
| SCHEMBL16150319 | 0.80 | CYP3A4 (0.66) | MEN1KMT2ATSHRPOLBALDH1A1 | |
| SCHEMBL4345924 | 0.79 | ALDH1A1 (0.52) | HPGDMEN1KMT2APOLBALDH1A1 | |
| SCHEMBL9416709 | 0.78 | TSHR (0.56) | HPGDMEN1KMT2ATSHRPKM | |
| SCHEMBL1503956 | 0.78 | TSHR (0.69) | HPGDMEN1KMT2ATSHRPOLB | |
| SCHEMBL8415139 | 0.77 | MEN1 (0.62) | HPGDMEN1KMT2APOLBALDH1A1 |
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 |