Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL15162320 | 0.80 | HSP90AA1 (0.47) | L3MBTL1ALDH1A1CYP1A2CYP2C19KMT2A | |
| SCHEMBL1127045 | 0.79 | TSHR (0.68) | ALDH1A1CYP1A2CYP2C19KMT2ATDP1 | |
| SCHEMBL15151391 | 0.76 | ALDH1A1 (0.72) | L3MBTL1ALDH1A1CYP1A2CYP2C19KMT2A | |
| SCHEMBL1991026 | 0.74 | ALDH1A1 (0.56) | ALDH1A1KMT2AHSD17B10TDP1MEN1 | |
| SCHEMBL23488205 | 0.73 | L3MBTL1 (0.66) | L3MBTL1ALDH1A1KMT2APKMHSD17B10 | |
| SCHEMBL11363402 | 0.71 | KMT2A (1.00) | L3MBTL1ALDH1A1CYP1A2CYP2C19KMT2A | |
| SCHEMBL257221 | 0.69 | KMT2A (0.69) | L3MBTL1ALDH1A1CYP1A2CYP2C19KMT2A | |
| SCHEMBL21484965 | 0.69 | TSHR (0.55) | ALDH1A1CYP1A2CYP2C19KMT2AHSD17B10 | |
| SCHEMBL25529106 | 0.69 | L3MBTL1 (0.44) | L3MBTL1ALDH1A1KMT2APKMHSD17B10 | |
| SCHEMBL28816299 | 0.68 | ALDH1A1 (0.57) | L3MBTL1ALDH1A1KMT2APKMHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110010-A1 | NOVEL PYRROLE COMPOUND | 微境生物医药科技(上海)有限公司 | 2021-06-10 | — | — | WO | disclosed |