Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.46 |
| ▸ | EPOR | P19235 | 5/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.36 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8957288 | 0.96 | ITGB3 (0.44) | ITGB3ITGA2BEPORHDAC8KDM4E | |
| SCHEMBL8957356 | 0.80 | ITGB3 (0.47) | ITGB3ITGA2BEPORHDAC8KDM4E | |
| SCHEMBL8099592 | 0.80 | SMN1; SMN2 (0.40) | ITGB3ITGA2BHDAC8TSHRPTPN1 | |
| SCHEMBL7516386 | 0.77 | PTPN1 (0.41) | ITGB3ITGA2BHDAC8PTPN1 | |
| SCHEMBL8957358 | 0.77 | ITGB3 (0.45) | ITGB3ITGA2BEPORKDM4ETSHR | |
| SCHEMBL8335482 | 0.76 | ACACB (0.40) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL6047694 | 0.76 | EPOR (0.40) | ITGB3ITGA2BEPOR | |
| SCHEMBL6047708 | 0.76 | EPOR (0.40) | ITGB3ITGA2BEPOR | |
| SCHEMBL21852438 | 0.74 | MAOB (0.38) | SMN1; SMN2 | |
| SCHEMBL92706 | 0.74 | ACACB (0.38) | KDM4EHTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5482700-A | Substituted polyamino, polycarboxy complexing agent dimers for MRI and X-ray contrast | SCHERING AKTIENGESELLSCHAFT (DE) | 1996-01-09 | — | — | US | disclosed |