Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAPGEF4 | Q8WZA2 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | UBE2N | P61088 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30877462 | 0.77 | ALDH1A1 (0.42) | L3MBTL1CA1CA2ALDH3A1POLB | |
| SCHEMBL30877247 | 0.76 | RAPGEF4 (0.51) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL30877392 | 0.76 | RAPGEF4 (0.48) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL7678499 | 0.75 | RAPGEF4 (0.56) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL30877518 | 0.74 | RAPGEF4 (0.49) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL30977550 | 0.74 | CYP2A6 (0.50) | RAPGEF4L3MBTL1CA1CA2POLB | |
| SCHEMBL30877401 | 0.73 | RAPGEF4 (0.48) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL30877380 | 0.73 | RAPGEF4 (0.48) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL30877495 | 0.73 | RAPGEF4 (0.48) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 | |
| SCHEMBL3188642 | 0.72 | RAPGEF4 (0.61) | RAPGEF4L3MBTL1CA1CA2ALDH3A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117964643-B | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-117964643-A | Pyrrole [2,3-b ] pyridine derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-05-03 | — | — | CN | disclosed |
| WO-2023168686-A1 | SUBSTITUTED CYCLOPENTANES AS CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2023-09-14 | — | — | WO | disclosed |
| WO-2023116884-A1 | CDK2 INHIBITORS AND USE THEREOF | QILU REGOR THERAPEUTICS INC. (CN) | 2023-06-29 | — | — | WO | disclosed |