Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.72 |
| ▸ | MAPT | P10636 | 3/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | ELANE | P08246 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | CFD | P00746 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL805920 | 0.90 | KDM4E (0.58) | KDM4EMAPTMAPK1LMNACYP3A4 | |
| SCHEMBL27580216 | 0.90 | KDM4E (0.58) | KDM4EMAPTMAPK1LMNACYP3A4 | |
| SCHEMBL11330589 | 0.86 | KDM4E (0.57) | KDM4EMAPTMAPK1LMNAPKM | |
| SCHEMBL19484789 | 0.85 | MAPT (0.78) | KDM4EMAPTMAPK1ELANELMNA | |
| SCHEMBL11386187 | 0.85 | KDM4E (0.77) | KDM4EMAPTMAPK1ELANELMNA | |
| SCHEMBL14034583 | 0.85 | KDM4E (0.56) | KDM4EMAPTMAPK1ELANELMNA | |
| SCHEMBL5603081 | 0.84 | KDM4E (1.00) | KDM4EMAPTMAPK1ELANELMNA | |
| SCHEMBL8349739 | 0.83 | KDM4E (0.55) | KDM4EMAPTMAPK1LMNAPKM | |
| SCHEMBL7952923 | 0.83 | KDM4E (0.68) | KDM4EMAPTMAPK1ELANELMNA | |
| SCHEMBL7326050 | 0.82 | KDM4E (0.53) | KDM4EMAPTMAPK1ELANELMNA |
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-2013029075-A1 | MEANS AND METHOD FOR ALKYLATION | TECHNISCHE UNIVERSITÄT GRAZ (AT) | 2013-03-07 | — | — | WO | disclosed |