Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 7/20 | 0.31 |
| ▸ | DPP8 | Q6V1X1 | 5/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 5/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Isoleucine SCHEMBL11421647 | 1.00 | KDM4E (0.38) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Isoleucine SCHEMBL9839164 | 1.00 | KDM4E (0.38) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6534640 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6534645 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1012467 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6534635 | 0.82 | KDM4E (0.42) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| Threonine SCHEMBL11423702 | 0.77 | SLC7A5 (0.34) | SLC7A5 | |
| Isoleucine SCHEMBL28476895 | 0.74 | SLC7A5 (0.52) | ALDH1A1DPP4DPP8DPP9DPP7 | |
| Isoleucine SCHEMBL28476896 | 0.74 | SLC7A5 (0.52) | ALDH1A1DPP4DPP8DPP9DPP7 | |
| Isoleucine SCHEMBL1255582 | 0.73 | SLC7A5 (0.55) | ALDH1A1DPP4DPP8DPP9DPP7 |
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-5068187-A | Culture of microorganisms to transform hydantoins to amino acids | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-11-26 | — | — | US | disclosed |