Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL12436840 | 1.00 | KCNJ1 (0.33) | KCNJ1HPGDIDO1ALDH1A1KDM4E | |
| SCHEMBL14261645 | 0.74 | KDM1A (0.30) | — | |
| SCHEMBL23835523 | 0.73 | SMYD3 (0.40) | IDO1KDM4EHTTL3MBTL1 | |
| SCHEMBL21789269 | 0.72 | SMYD3 (0.36) | IDO1 | |
| SCHEMBL23834982 | 0.72 | SMYD3 (0.36) | IDO1 | |
| SCHEMBL8388948 | 0.71 | IDO1 (0.37) | IDO1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL21774821 | 0.71 | SMYD3 (0.36) | IDO1 | |
| Hydrochloric Acid SCHEMBL21774820 | 0.71 | SMYD3 (0.36) | IDO1 | |
| SCHEMBL2982032 | 0.70 | IDO1 (0.36) | IDO1ALDH1A1 | |
| SCHEMBL21789271 | 0.69 | JAK1 (0.45) | L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE49686-E1 | Nitrogen-containing heterocyclic compound and use of same | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2023-10-10 | — | — | US | disclosed |
| US-RE49686-E1 | Nitrogen-containing heterocyclic compound and use of same | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2023-10-10 | — | — | US | disclosed |
| US-RE48334-E1 | Nitrogen-containing heterocyclic compound and use of same | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2020-12-01 | — | — | US | disclosed |