Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TACR3 | P29371 | 1/20 | 0.36 |
| ▸ | GNAI3 | P08754 | 2/20 | 0.35 |
| ▸ | GNAO1 | P09471 | 2/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 2/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 2/20 | 0.34 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.34 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12448272 | 0.87 | DPP4 (0.39) | NPC1MEN1KMT2APOLBMAPT | |
| SCHEMBL12876369 | 0.83 | EPHX2 (0.41) | NPC1MEN1KMT2APOLBMAPT | |
| SCHEMBL22150392 | 0.83 | EPHX2 (0.41) | NPC1MEN1KMT2APOLBMAPT | |
| SCHEMBL24614018 | 0.83 | SMN1; SMN2 (0.44) | NPC1MEN1KMT2APOLBTACR3 | |
| SCHEMBL25468526 | 0.81 | HSD17B10 (0.38) | NPC1MEN1KMT2ATACR3ALDH1A1 | |
| SCHEMBL26375593 | 0.80 | NPC1 (0.49) | NPC1MEN1KMT2APOLBMAPT | |
| SCHEMBL17522138 | 0.80 | PIK3CD (0.43) | NPC1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL17522199 | 0.80 | PIK3CD (0.43) | NPC1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL17522201 | 0.80 | PIK3CD (0.43) | NPC1MEN1KMT2APOLBALDH1A1 | |
| SCHEMBL24614016 | 0.79 | FAAH (0.40) | NPC1TACR3ALDH1A1LMNADPP4 |
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-2018102419-A1 | COMPOUNDS CONTAINING A SULFONIC GROUP AS KAT INHIBITORS | Epizyme, Inc. (US) | 2018-06-07 | — | — | WO | disclosed |