Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | BCL2 | P10415 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CTRC | Q99895 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10414133 | 0.74 | KCNH2 (0.42) | MEN1KMT2AALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7465411 | 0.73 | CALM1 (0.44) | CALM1MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL1196532 | 0.72 | CALM1 (0.42) | CALM1MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL27966598 | 0.71 | MEN1 (0.44) | CALM1MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL10322438 | 0.71 | CALM1 (0.46) | CALM1MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL7457661 | 0.71 | CALM1 (0.41) | CALM1MEN1KMT2ACYP3A4HPGD | |
| SCHEMBL15064040 | 0.70 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL8318175 | 0.70 | ALDH1A1 (0.35) | CYP3A4HPGDHSD17B10ALDH1A1 | |
| SCHEMBL3295742 | 0.69 | MEN1 (0.61) | MEN1KMT2ACYP3A4HPGDALOX15 | |
| SCHEMBL8106404 | 0.69 | CALM1 (0.39) | CALM1MEN1KMT2ACYP3A4HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140900-A4 | PYRAZOLE COMPOUNDS AND USES THEREOF | PPD DISCOVERY INC (US) | 2002-04-10 | — | — | EP | disclosed |
| EP-1140900-A2 | PYRAZOLE COMPOUNDS AND USES THEREOF | PPD DISCOVERY, INC. (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000039083-A2 | PYRAZOLE COMPOUNDS AND USES THEREOF | PPD DISCOVERY, INC. (US) | 2000-07-06 | — | — | WO | disclosed |