Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.43 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL876292 | 0.80 | ALDH1A1 (0.51) | ALDH1A1DDB1CRBNGAAHTT | |
| SCHEMBL28650761 | 0.79 | ALDH1A1 (0.50) | ALDH1A1DDB1CRBNGAAHTT | |
| SCHEMBL29088638 | 0.78 | ALDH1A1 (0.46) | ALDH1A1DDB1CRBNHTTKDM4E | |
| SCHEMBL31220632 | 0.76 | ALDH1A1 (0.47) | ALDH1A1DDB1CRBNHTTPKM | |
| Benzene SCHEMBL27893007 | 0.76 | TSHR (0.43) | ALDH1A1DDB1CRBNGAAHTT | |
| SCHEMBL1068302 | 0.75 | GAA (0.48) | ALDH1A1DDB1CRBNGAAF2 | |
| SCHEMBL5227458 | 0.75 | GPBAR1 (0.51) | DDB1CRBNGAAPKMTSHR | |
| SCHEMBL274968 | 0.75 | GPBAR1 (0.51) | DDB1CRBNGAAPKMTSHR | |
| SCHEMBL9386437 | 0.74 | ALDH1A1 (0.45) | ALDH1A1DDB1CRBNLMNAPKM | |
| Ammonia Solution, Strong SCHEMBL9774304 | 0.74 | GAA (0.47) | ALDH1A1DDB1CRBNGAAF2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023104209-A1 | METTL3 INHIBITOR COMPOUND | 上海昂阔医药有限公司 | 2023-06-15 | — | — | WO | disclosed |
| WO-2023030385-A1 | PYRIMIDINE-FUSED CYCLIC COMPOUND AND PREPARATION METHOD AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-03-09 | — | — | WO | disclosed |