Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.67 |
| ▸ | CES1 | P23141 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | APEX1 | P27695 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL747850 | 0.87 | NPC1 (0.71) | CES2CES1KMT2ANPC1RAB9A | |
| SCHEMBL4197234 | 0.87 | NPC1 (0.71) | CES2CES1KMT2ANPC1RAB9A | |
| SCHEMBL2156563 | 0.81 | CES2 (1.00) | CES2CES1NPC1RAB9ANPSR1 | |
| SCHEMBL28972841 | 0.81 | NPC1 (0.63) | CES2CES1KMT2ANPC1RAB9A | |
| SCHEMBL4483889 | 0.80 | NPC1 (0.77) | CES2CES1KMT2ANPC1RAB9A | |
| Bromide SCHEMBL981452 | 0.79 | CES2 (0.96) | CES2CES1NPC1RAB9ANPSR1 | |
| Hydrochloric Acid SCHEMBL905770 | 0.79 | CES2 (0.96) | CES2CES1NPC1RAB9ANPSR1 | |
| SCHEMBL153386 | 0.79 | ALDH1A1 (0.76) | CES2CES1KMT2ANPC1MAPT | |
| SCHEMBL16203309 | 0.79 | KMT2A (0.68) | CES2CES1KMT2ANPC1RAB9A | |
| SCHEMBL10457517 | 0.78 | NPC1 (0.60) | CES2CES1KMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2155262-A2 | COMPOSITIONS FOR TARGETED IMAGING AND THERAPY | Radiomedix Inc. (US) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008119036-A2 | COMPOSITIONS FOR TARGETED IMAGING AND THERAPY | RADIOMEDIX INC. (US) | 2008-10-02 | — | — | WO | disclosed |