Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2003577 | 0.91 | KMT2A (0.52) | TP53KMT2AALOX15ALDH1A1SMN1; SMN2 | |
| Hydrogen Peroxide SCHEMBL28455182 | 0.84 | KMT2A (0.73) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| Benzene SCHEMBL8209405 | 0.84 | KMT2A (0.73) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL11373627 | 0.84 | KMT2A (0.73) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL15116 | 0.84 | KMT2A (0.73) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL15312863 | 0.82 | KMT2A (0.70) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL6351346 | 0.82 | HSD17B3 (0.57) | ALDH1A1HPGDKDM4ECYP3A4MAPT | |
| SCHEMBL11122984 | 0.82 | KMT2A (0.70) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL21597902 | 0.82 | KMT2A (0.70) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL21597904 | 0.82 | KMT2A (0.70) | KMT2AALOX15ALDH1A1SMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991016046-A1 | USE OF ACETOACETYL CARBOXYLIC ACID DERIVATIVES FOR IMMUNOSUPPRESSION | CETUS CORPORATION (US) | 1991-10-31 | — | — | WO | disclosed |