Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.35 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23531201 | 1.00 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 | |
| SCHEMBL28023583 | 0.83 | GABRP (0.41) | ALDH1A1TP53TSHRMRGPRX4GABRP | |
| SCHEMBL28207180 | 0.81 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2TSHRLMNAMEN1 | |
| SCHEMBL30281026 | 0.76 | TDP1 (0.41) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 | |
| SCHEMBL23090022 | 0.76 | TDP1 (0.41) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 | |
| SCHEMBL7863967 | 0.74 | CYP3A4 (0.40) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 | |
| SCHEMBL30280735 | 0.73 | MAPT (0.37) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL28876061 | 0.73 | MAPT (0.37) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL23880557 | 0.72 | CYP3A4 (0.48) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 | |
| SCHEMBL12931054 | 0.72 | MAP2K1 (0.47) | ALDH1A1SMN1; SMN2TP53TSHRCASP1 |
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-116139138-A | Heterocyclic modulators of lipid synthesis | 3-V生物科学股份有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-110177551-B | Heterocyclic modulators of lipid synthesis | 3-V生物科学股份有限公司 | 2023-02-17 | — | — | CN | disclosed |