Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8754981 | 0.93 | KDM4E (0.47) | KDM4EPARP1ALDH1A1BCAT2TSHR | |
| SCHEMBL1758773 | 0.91 | ALDH1A1 (0.46) | KDM4EALDH1A1ALOX15G6PDCASP7 | |
| SCHEMBL28973887 | 0.89 | ALDH1A1 (0.44) | KDM4EALDH1A1ALOX15G6PDCASP7 | |
| SCHEMBL9543523 | 0.83 | KDM4E (0.50) | KDM4EPARP1ALDH1A1G6PDCASP7 | |
| SCHEMBL8824319 | 0.83 | GABRA1 (0.44) | KDM4EPARP1ALDH1A1TSHRHSD17B10 | |
| SCHEMBL461024 | 0.83 | MMP2 (0.50) | KDM4EALDH1A1ALOX15G6PDCASP7 | |
| SCHEMBL9419211 | 0.83 | ALDH1A1 (0.45) | KDM4EPARP1ALDH1A1MMP2BCAT2 | |
| Phthalic Acid SCHEMBL28339804 | 0.81 | ALDH1A1 (0.47) | KDM4EALDH1A1ALOX15BCAT2TSHR | |
| SCHEMBL14058648 | 0.81 | KDM4E (0.42) | KDM4EPARP1ALDH1A1TSHRHSD17B10 | |
| SCHEMBL19136172 | 0.81 | BCAT2 (0.57) | KDM4EPARP1ALOX15BCAT2SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0484328-A1 | PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS. | MALLINCKRODT INC (US) | 1992-05-13 | — | — | EP | disclosed |
| WO-1991001296-A1 | PROCESS FOR THE PREPARATION OF 2,4,6-TRIIODO-5-AMINO-N-ALKYLISOPHTHALAMIC ACID AND 2,4,6-TRIIODO-5-AMINO-ISOPHTHALAMIDE COMPOUNDS | MALLINCKRODT, INC. (US) | 1991-02-07 | — | — | WO | disclosed |