Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3877835 | 0.75 | CA2 (0.44) | AKR1B1KEAP1RIPK1LMNAKMT2A | |
| SCHEMBL29191170 | 0.67 | DPP4 (0.43) | AKR1B1DPP4RIPK1PIN1 | |
| SCHEMBL776975 | 0.66 | SLC6A2 (0.39) | — | |
| SCHEMBL30919460 | 0.66 | SLC6A2 (0.39) | — | |
| Iodide SCHEMBL29040390 | 0.65 | DPP4 (0.42) | AKR1B1DPP4RIPK1PIN1 | |
| SCHEMBL16815808 | 0.65 | SMN1; SMN2 (0.44) | KEAP1DPP4RIPK1PIN1 | |
| SCHEMBL776996 | 0.65 | IDO1 (0.48) | LMNAKMT2AMEN1ALDH1A1 | |
| SCHEMBL8252287 | 0.64 | GABRA1 (0.54) | AKR1B1DPP4RIPK1PIN1CTSS | |
| SCHEMBL3870573 | 0.64 | RIPK1 (0.39) | AKR1B1KEAP1RIPK1LMNACTSL | |
| SCHEMBL21690071 | 0.64 | NOS3 (0.50) | DPP4LMNAKMT2AMEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117777121-A | Compounds and uses thereof | 詹森药业有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-110099898-B | Compounds and uses thereof | 优曼尼蒂治疗公司 | 2023-07-25 | — | — | CN | disclosed |