Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 6/20 | 0.57 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.57 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.57 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.56 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.56 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.56 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL288751 | 0.95 | F10 (0.56) | F10PRSS1PRSS2PRSS3HDAC3 | |
| SCHEMBL7118443 | 0.90 | ITGB3 (0.64) | F10PRSS1PRSS2PRSS3LOXL2 | |
| SCHEMBL18551279 | 0.83 | HDAC3 (0.63) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL24358735 | 0.83 | PRSS1 (0.67) | F10PRSS1PRSS2PRSS3LOXL2 | |
| SCHEMBL29165907 | 0.83 | MAPT (0.59) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL30851123 | 0.83 | MAPT (0.59) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL9403827 | 0.81 | MAPT (0.62) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL25342051 | 0.81 | HDAC3 (0.76) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL11845387 | 0.81 | HDAC3 (0.65) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL7090553 | 0.81 | F10 (0.71) | F10PRSS1PRSS2PRSS3LOXL2 |
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-2427476-A1 | BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY | Polyphor Ag (CH) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010127704-A1 | BETA-HAIRPIN PEPTIDOMIMETICS HAVING CXCR4 ANTAGONIZING ACTIVITY | POLYPHOR AG (CH) | 2010-11-11 | — | — | WO | disclosed |