Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7950797 | 0.87 | AKR1B1 (0.43) | ERN1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL29593387 | 0.80 | AKR1C3 (0.63) | KDM4EAKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL4891804 | 0.80 | AKR1C3 (0.63) | KDM4EAKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL895511 | 0.78 | AKR1C4 (0.67) | ERN1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL4072963 | 0.78 | ALDH1A1 (0.43) | KDM4EMAPTMEN1KMT2AAKR1C4 | |
| SCHEMBL16644420 | 0.76 | DGAT1 (0.46) | ERN1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL3238108 | 0.75 | GSK3B (0.41) | KDM4EMAPTMEN1KMT2AAKR1C4 | |
| SCHEMBL10495679 | 0.74 | CA1 (0.44) | ERN1MAPTMEN1KMT2AAKR1C4 | |
| SCHEMBL31700545 | 0.74 | ERN1 (0.61) | ERN1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL19423432 | 0.74 | HSD17B10 (0.47) | ERN1KDM4EMAPTMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0075881-B1 | 7-DEAZAPURINE DERIVATIVES | Takeda Chemical Industries, Ltd. (JP) | 1985-02-13 | — | — | EP | disclosed |
| US-4435570-A | ANTITUMOR AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1984-03-06 | — | — | US | disclosed |
| EP-0075881-A1 | 7-Deazapurine derivatives | Takeda Chemical Industries, Ltd. (JP) | 1983-04-06 | — | — | EP | disclosed |