Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.56 |
| ▸ | TACR1 | P25103 | 7/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.45 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.45 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.45 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.45 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4438527 | 0.87 | CES2 (0.50) | ACP3TACR1CES2CES1ALDH1A1 | |
| SCHEMBL27683652 | 0.85 | ACP3 (0.59) | ACP3TACR1PTPN1PDPK1CNR2 | |
| SCHEMBL11103452 | 0.85 | ACP3 (0.55) | ACP3TACR1CES2ALDH1A1RAB9A | |
| SCHEMBL396389 | 0.82 | L3MBTL1 (0.56) | CES2CES1ALDH1A1 | |
| Benzene SCHEMBL27414119 | 0.82 | L3MBTL1 (0.56) | CES2CES1ALDH1A1 | |
| SCHEMBL4436009 | 0.82 | MEN1 (0.43) | ACP3TACR1PTPN1CNR2CES2 | |
| SCHEMBL4433334 | 0.82 | HDAC4 (0.52) | ACP3TACR1CNR2CES2CES1 | |
| SCHEMBL28212173 | 0.82 | ACP3 (0.56) | ACP3TACR1PTPN1PDPK1CNR2 | |
| SCHEMBL27664005 | 0.81 | KMT2A (0.51) | ACP3TACR1PTPN1PDPK1CNR2 | |
| SCHEMBL4433967 | 0.81 | ACP3 (0.41) | ACP3TACR1CNR2CES2CES1 |
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-2349999-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | Universität des Saarlandes (DE) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010043711-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | UNIVERSITAET DES SAARLANDES (DE) | 2010-04-22 | — | — | WO | disclosed |