Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4281409 | 0.78 | ALDH1A1 (0.38) | KDM4EGAAMAPTCYP1A2CYP3A4 | |
| SCHEMBL4285848 | 0.76 | SLC6A2 (0.42) | KDM4EMAPTALDH1A1HTT | |
| SCHEMBL4288935 | 0.75 | TSHR (0.39) | MAPTLMNAHTTNPSR1L3MBTL1 | |
| SCHEMBL4291881 | 0.74 | SLC6A3 (0.40) | MAPTALDH1A1 | |
| SCHEMBL4282253 | 0.74 | TACR1 (0.41) | NPSR1 | |
| SCHEMBL4280118 | 0.74 | HTR2A (0.40) | — | |
| SCHEMBL4285491 | 0.73 | KMT2A (0.41) | ALDH1A1HTTKMT2A | |
| SCHEMBL4282511 | 0.72 | HSD17B10 (0.46) | GAACYP2C9CYP2C19ALDH1A1LMNA | |
| SCHEMBL4294068 | 0.71 | POLB (0.36) | KDM4EGAAMAPTCYP3A4ALDH1A1 | |
| SCHEMBL4292808 | 0.71 | SLC6A3 (0.45) | HTT |
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-2009072643-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-11 | — | — | WO | disclosed |