Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | RAB9A | P51151 | 8/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 7/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL13189076 | 0.87 | ALDH1A1 (0.66) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 | |
| SCHEMBL3714334 | 0.86 | PIK3CG (0.44) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 | |
| SCHEMBL3710470 | 0.82 | NPC1 (0.61) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 | |
| SCHEMBL3717238 | 0.79 | PIK3CD (0.47) | KDM4EKMT2AALDH1A1HSD17B10HPGD | |
| SCHEMBL13188526 | 0.78 | DYRK1A (0.46) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 | |
| SCHEMBL13188525 | 0.78 | PIK3CA (0.52) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 | |
| SCHEMBL10962068 | 0.78 | MAPT (0.58) | NPC1RAB9ASMN1; SMN2MEN1KMT2A | |
| SCHEMBL3706248 | 0.77 | PIK3CA (0.51) | PRKDC | |
| SCHEMBL1651590 | 0.77 | PIK3CA (0.59) | NPC1RAB9ASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL3711298 | 0.76 | DYRK1A (0.43) | NPC1RAB9AKDM4ESMN1; SMN2RXFP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010100144-A1 | FUSED BICYCLIC COMPOUNDS AS INHIBITORS FOR PI3 KINASE | MERCK SERONO S.A. (CH) | 2010-09-10 | — | — | WO | disclosed |