Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | S100A4 | P26447 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1485627 | 0.85 | NPC1 (0.45) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL15854534 | 0.84 | PRSS1 (0.50) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL19174928 | 0.83 | ALDH1A1 (0.52) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL6029803 | 0.83 | MAPT (0.55) | NPC1RAB9APRSS1ALDH1A1LMNA | |
| SCHEMBL30935123 | 0.83 | ALDH1A1 (0.52) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL12952913 | 0.82 | MAPT (0.55) | NPC1RAB9APRSS1ALDH1A1LMNA | |
| SCHEMBL27778855 | 0.81 | NPC1 (0.51) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL3039038 | 0.81 | LMNA (0.51) | NPC1RECQLRAB9AALDH1A1LMNA | |
| SCHEMBL2646691 | 0.81 | PRSS1 (0.42) | NPC1RECQLRAB9APRSS1ALDH1A1 | |
| SCHEMBL5164937 | 0.81 | KDM4E (0.64) | NPC1RECQLRAB9APRSS1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105163738-A | MK2 inhibitors and uses thereof | CELGENE AVILOMICS RES INC | 2015-12-16 | — | — | CN | disclosed |