Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.61 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.51 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7856482 | 0.86 | ITGB3 (0.65) | ITGB3ITGA2BSIRT1GFERMAPT | |
| SCHEMBL7864280 | 0.84 | ITGB3 (0.62) | ITGB3ITGA2BSMN1; SMN2SIRT1GFER | |
| SCHEMBL7861970 | 0.83 | ITGB3 (0.76) | ITGB3ITGA2BSMN1; SMN2SIRT1KMT2A | |
| SCHEMBL15295153 | 0.82 | MEN1 (0.67) | ITGB3ITGA2BHDAC3MAPK1ADRA1A | |
| SCHEMBL4110638 | 0.82 | NR1H4 (0.55) | ITGB3ITGA2BHDAC3MAPK1ADRA1A | |
| SCHEMBL4407485 | 0.81 | ATM (0.56) | ITGB3ITGA2BHDAC3HDAC4HDAC1 | |
| Hydrochloric Acid SCHEMBL10360584 | 0.81 | NR1H4 (0.53) | ITGB3ITGA2BHDAC3MAPK1ADRA1A | |
| SCHEMBL10973331 | 0.80 | ITGB3 (0.64) | ITGB3ITGA2BHDAC3MAPK1ADRA1A | |
| SCHEMBL6014406 | 0.79 | HTR6 (0.45) | ITGB3ITGA2BCYP2D6AOC3 | |
| SCHEMBL8371139 | 0.79 | ITGB3 (0.57) | ITGB3ITGA2BSMN1; SMN2SIRT1POLB |
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 |