Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 13/20 | 0.73 |
| ▸ | RAB9A | P51151 | 13/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 11/20 | 0.73 |
| ▸ | MEN1 | O00255 | 10/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.73 |
| ▸ | HPGD | P15428 | 4/20 | 0.73 |
| ▸ | PKM | P14618 | 3/20 | 0.73 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.73 |
| ▸ | MAPT | P10636 | 11/20 | 0.70 |
| ▸ | LMNA | P02545 | 5/20 | 0.70 |
| ▸ | GAA | P10253 | 4/20 | 0.70 |
| ▸ | GLA | P06280 | 2/20 | 0.70 |
| ▸ | TP53 | P04637 | 1/20 | 0.70 |
| ▸ | ATP4A | P20648 | 1/20 | 0.56 |
| ▸ | ATP4B | P51164 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.54 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL31305038 | 0.90 | NPC1 (0.89) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL31252953 | 0.88 | MAPT (0.71) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL2497906 | 0.88 | MAPT (0.71) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL2497904 | 0.88 | MAPT (0.71) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL1298605 | 0.87 | MAPT (0.66) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL31252955 | 0.87 | MAPT (0.66) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL1298603 | 0.87 | MAPT (0.66) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL537905 | 0.85 | NPC1 (1.00) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL29660212 | 0.85 | NPC1 (1.00) | NPC1RAB9AKMT2AMEN1KDM4E | |
| SCHEMBL537904 | 0.85 | NPC1 (1.00) | NPC1RAB9AKMT2AMEN1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014044757-A1 | CATIONIC TRIPHENYLAMINE DERIVATIVES ACTIVABLE BY VISIBLE AND INFRA RED LIGHT FOR INDUCING AND IMAGING APOPTOSIS IN CANCER CELLS | INSTITUT CURIE (FR) | 2014-03-27 | — | — | WO | disclosed |
| EP-2711366-A1 | Cationic triphenylamine derivatives activable by visible and Infra Red light for inducing and imaging apoptosis in cancer cells | Institut Curie (FR) | 2014-03-26 | — | — | EP | disclosed |