Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | FASN | P49327 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29720106 | 0.85 | CA12 (0.64) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL42942 | 0.85 | CA12 (0.64) | NPC1RAB9ACA12CA1CA2 | |
| Acetophenone SCHEMBL27938364 | 0.83 | CA12 (0.63) | NPC1RAB9ACA12CA1CA2 | |
| Acetophenone SCHEMBL27691800 | 0.83 | HPGD (0.56) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL30293783 | 0.81 | KDM4E (0.61) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL40865 | 0.81 | KDM4E (0.61) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL1758482 | 0.80 | LIG1 (0.63) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL11410201 | 0.79 | KDM4E (0.58) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL10781613 | 0.79 | KDM4E (0.58) | NPC1RAB9ACA12CA1CA2 | |
| SCHEMBL31407012 | 0.79 | KDM4E (0.58) | NPC1RAB9ACA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9758874-B2 | Plating bath composition and method for electroless plating of palladium | ATOTECH DEUTSCHLAND GMBH (DE) | 2017-09-12 | — | — | US | claimed |
| US-20030170180-A1 | Non-lethal chemical weapons | BAHARY WILLIAM S (US) | 2003-09-11 | — | — | US | disclosed |