Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4461350 | 0.89 | NPC1 (0.41) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL21017579 | 0.85 | NPC1 (0.47) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL19171338 | 0.84 | NPC1 (0.57) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL20017302 | 0.81 | NPC1 (0.55) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL19164342 | 0.79 | NPC1 (0.53) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL19171376 | 0.79 | EPHX1 (0.57) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL21351799 | 0.78 | DNM1 (0.46) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL7816137 | 0.77 | KDM4C (0.67) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL3512602 | 0.77 | NPC1 (0.52) | NPC1RAB9AMAPTSMN1; SMN2KDM4C | |
| SCHEMBL19171947 | 0.77 | EPHX1 (0.60) | NPC1RAB9AMAPTSMN1; SMN2KDM4C |
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-20050032661-A1 | Use of transition metal complexes with nitrogen-containing polydentate ligands as a bleaching catalyst and bleaching agent composition | DEGUSSA AG | 2005-02-10 | — | — | US | disclosed |