Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | ECE1 | P42892 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7471469 | 0.86 | HDAC1 (0.58) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL2234114 | 0.82 | SLC1A2 (0.54) | LMNAHDAC1HDAC6NPC1RAB9A | |
| SCHEMBL27739096 | 0.82 | CASP3 (0.60) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL14660540 | 0.82 | CASP3 (0.60) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL30038032 | 0.82 | CASP3 (0.60) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL2240935 | 0.81 | CYP1A2 (0.55) | EPHX2CYP2C9CYP2C19PLOD2CYP3A4 | |
| SCHEMBL16031690 | 0.81 | LMNA (0.55) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL27868838 | 0.78 | LMNA (0.52) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL30037941 | 0.77 | CA2 (0.54) | LMNAECE1HDAC1HDAC6THRB | |
| SCHEMBL28830880 | 0.77 | CA2 (0.54) | LMNAECE1HDAC1HDAC6THRB |
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-2531520-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | Polyphor AG (CH) | 2012-12-12 | — | — | EP | disclosed |
| WO-2011095607-A1 | TEMPLATE-FIXED PEPTIDOMIMETICS WITH CXCR7 MODULATING ACTIVITY | POLYPHOR AG (CH) | 2011-08-11 | — | — | WO | disclosed |