Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 6/20 | 0.67 |
| ▸ | CDC25A | P30304 | 1/20 | 0.66 |
| ▸ | PLK1 | P53350 | 5/20 | 0.57 |
| ▸ | CNR2 | P34972 | 1/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ICMT | O60725 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11831641 | 0.89 | HTR6 (0.63) | HTR6CDC25ACNR2ICMT | |
| SCHEMBL15747715 | 0.84 | CDC25A (0.80) | CDC25APLK1CNR2MCL1ALDH1A1 | |
| SCHEMBL2465449 | 0.82 | CDC25A (0.68) | HTR6CDC25APLK1MCL1ALDH1A1 | |
| SCHEMBL29379289 | 0.82 | CDC25A (0.68) | HTR6CDC25APLK1MCL1ALDH1A1 | |
| SCHEMBL15747729 | 0.82 | CDC25A (0.90) | CDC25APLK1CNR2MCL1ALDH1A1 | |
| SCHEMBL8128733 | 0.82 | CDC25A (0.71) | CDC25APLK1MCL1ALDH1A1LMNA | |
| SCHEMBL29376139 | 0.81 | CDC25A (0.67) | CDC25APLK1MCL1ALDH1A1LMNA | |
| SCHEMBL11837942 | 0.81 | HTR6 (0.60) | HTR6CDC25ACNR2ICMT | |
| SCHEMBL11837951 | 0.81 | HTR6 (0.60) | HTR6CDC25ACNR2ICMT | |
| SCHEMBL3743075 | 0.81 | CDC25A (0.70) | CDC25APLK1MCL1ALDH1A1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5631279-A | ANTAGONISTS OF NEUROKININ A | RHONE-POULENC RORER, S.A. (FR) | 1997-05-20 | — | — | US | disclosed |