Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 2/20 | 0.36 |
| ▸ | EGLN2 | Q96KS0 | 3/20 | 0.34 |
| ▸ | CTSK | P43235 | 4/20 | 0.33 |
| ▸ | CTSS | P25774 | 2/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | BCL2 | P10415 | 1/20 | 0.31 |
| ▸ | BECN1 | Q14457 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28612240 | 0.86 | ALDH1A1 (0.38) | MAPK14RAB9ASMN1; SMN2LMNA | |
| SCHEMBL16629232 | 0.75 | ALDH1A1 (0.46) | NPC1RAB9ASMN1; SMN2KDM4ELMNA | |
| SCHEMBL22858331 | 0.74 | AAK1 (0.39) | MAPK14CTSKCTSSAAK1BCL2 | |
| SCHEMBL30079060 | 0.73 | EGLN2 (0.36) | MAPK14EGLN2CTSKTTKCA1 | |
| SCHEMBL16629294 | 0.72 | CTSD (0.30) | CTSSCTSB | |
| SCHEMBL29766611 | 0.72 | — | — | |
| SCHEMBL16629292 | 0.71 | — | — | |
| SCHEMBL3304675 | 0.70 | AAK1 (0.39) | MAPK14AAK1LCKNPC1RECQL | |
| SCHEMBL15274043 | 0.70 | SSTR4 (0.32) | — | |
| SCHEMBL30661581 | 0.70 | AAK1 (0.39) | MAPK14AAK1LCKNPC1RECQL |
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-2015050989-A2 | MACROCYCLIC COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISEASES | CS THERAPEUTICS INC. (US) | 2015-04-09 | — | — | WO | disclosed |