Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.44 |
| ▸ | EPOR | P19235 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.35 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8957276 | 0.96 | ITGB3 (0.46) | ITGB3ITGA2BEPORHDAC8KDM4E | |
| SCHEMBL8099592 | 0.85 | SMN1; SMN2 (0.40) | ITGB3ITGA2BHDAC8TSHRPTPN1 | |
| SCHEMBL7516386 | 0.83 | PTPN1 (0.41) | ITGB3ITGA2BHDAC8PTPN1 | |
| SCHEMBL8957358 | 0.81 | ITGB3 (0.45) | ITGB3ITGA2BEPORCYP1A2CYP2D6 | |
| SCHEMBL6047694 | 0.80 | EPOR (0.40) | ITGB3ITGA2BEPOR | |
| SCHEMBL6047708 | 0.80 | EPOR (0.40) | ITGB3ITGA2BEPOR | |
| SCHEMBL21852438 | 0.80 | MAOB (0.38) | SMN1; SMN2 | |
| SCHEMBL15044629 | 0.79 | ACACB (0.38) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL92706 | 0.79 | ACACB (0.38) | KDM4EHTTSMN1; SMN2 | |
| SCHEMBL8902337 | 0.77 | NR1D1 (0.42) | — |
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 |