Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL872046 | 0.84 | LMNA (0.52) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL31588310 | 0.84 | LMNA (0.52) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL28168750 | 0.83 | HTR2A (0.40) | MEN1KMT2AALDH1A1HTR2ACALM1 | |
| Formic Acid SCHEMBL27989933 | 0.82 | BCL2 (0.45) | TSHRHTR2ACALM1BCL2BCL2L1 | |
| SCHEMBL28089806 | 0.82 | HTR2A (0.42) | MEN1LMNAKMT2AALDH1A1HTR2A | |
| SCHEMBL28023181 | 0.82 | LIPG (0.38) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL7735333 | 0.81 | CALM1 (0.55) | MEN1KMT2AHTR2ACALM1BCL2 | |
| SCHEMBL10489995 | 0.80 | NFE2L2 (0.43) | HTR2ACALM1BCL2BCL2L1TBXA2R | |
| SCHEMBL19209982 | 0.80 | PTGER3 (0.58) | HTTTBXA2RPTGER3PTGER2PTGDR | |
| SCHEMBL2957802 | 0.80 | PTGER3 (0.36) | HTR2ACALM1BCL2BCL2L1CYP1A2 |
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-117924964-A | Carbene dye containing diazepine structure and preparation method thereof | 山东中康国创先进印染技术研究院有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-117185999-A | Green synthesis method of 3, 4-dihydro-2 (1H) -quinolinone bioactive framework | 青岛农业大学 | 2023-12-08 | — | — | CN | disclosed |