Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | PDE5A | O76074 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL20985683 | 0.82 | ALDH1A1 (0.41) | ALDH1A1RAB9AHIF1ANPSR1POLB | |
| SCHEMBL29975807 | 0.74 | TP53 (0.32) | MEN1KMT2ALMNA | |
| SCHEMBL21019918 | 0.68 | ALDH1A1 (0.41) | ALDH1A1RAB9AHIF1ANPSR1POLB | |
| SCHEMBL20985685 | 0.67 | LMNA (0.35) | ALDH1A1LMNASMN1; SMN2PKMHTT | |
| SCHEMBL30526112 | 0.67 | LMNA (0.35) | ALDH1A1LMNASMN1; SMN2PKMHTT | |
| SCHEMBL8665363 | 0.67 | HTT (0.59) | ALDH1A1POLBHPGDPDE5ALMNA | |
| SCHEMBL21020129 | 0.67 | OPRM1 (0.32) | ALDH1A1MEN1KMT2AHPGDLMNA | |
| SCHEMBL21019475 | 0.66 | TRPM8 (0.37) | LMNASMN1; SMN2PKMHTTGAA | |
| SCHEMBL21019761 | 0.65 | CHRM1 (0.38) | ALDH1A1POLBKMT2APDE5ASMN1; SMN2 | |
| SCHEMBL28910501 | 0.65 | S1PR1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110023292-B | Apoptosis inhibitors | 北京生命科学研究所 | 2022-10-04 | — | — | CN | disclosed |