Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7522877 | 0.78 | — | — | |
| SCHEMBL7530353 | 0.76 | PTPN1 (0.50) | PTPN1ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL30831886 | 0.71 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2KDM4ETSHR | |
| SCHEMBL27198408 | 0.71 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2KDM4ETSHR | |
| SCHEMBL27950508 | 0.70 | KDM4E (0.33) | ALDH1A1KDM4E | |
| SCHEMBL13479795 | 0.67 | MAPK1 (0.38) | ALDH1A1SMN1; SMN2TSHRHTT | |
| SCHEMBL28669928 | 0.66 | CA2 (0.48) | PTPN1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL13488531 | 0.64 | PTPN1 (0.55) | PTPN1ALDH1A1SMN1; SMN2KDM4ETSHR | |
| SCHEMBL8380519 | 0.64 | CA1 (0.48) | PTPN1ALDH1A1SMN1; SMN2KDM4ETSHR | |
| SCHEMBL29049264 | 0.64 | CA12 (0.48) | PTPN1ALDH1A1SMN1; SMN2KDM4ETSHR |
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-1186305-A1 | New brominated compounds as contrast media for X-ray mammography | Schering Aktiengesellschaft (DE) | 2002-03-13 | — | — | EP | claimed |
| EP-1186305-A1 | New brominated compounds as contrast media for X-ray mammography | Schering Aktiengesellschaft (DE) | 2002-03-13 | — | — | EP | disclosed |