Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.46 |
| ▸ | NNMT | P40261 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | OXTR | P30559 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29279277 | 0.85 | KMT2A (0.49) | TSHRSLC6A3KMT2AMAPTALDH1A1 | |
| SCHEMBL27526720 | 0.82 | KMT2A (0.52) | TSHRNNMTNPC1RAB9AKMT2A | |
| SCHEMBL28678174 | 0.79 | MAPT (0.47) | SIRT6NNMTNPC1RAB9AKMT2A | |
| SCHEMBL27653513 | 0.78 | ALDH1A1 (0.65) | TSHRSLC6A3NPC1RAB9AKMT2A | |
| SCHEMBL26374989 | 0.77 | KMT2A (0.52) | NPC1RAB9AKMT2AMAPTALDH1A1 | |
| SCHEMBL27302783 | 0.77 | KMT2A (0.50) | TSHRSLC6A3NPC1RAB9AKMT2A | |
| SCHEMBL23486304 | 0.76 | MAPT (0.56) | TSHRKMT2AMAPTALDH1A1LMNA | |
| SCHEMBL31426894 | 0.76 | KMT2A (0.53) | NPC1RAB9AKMT2AMAPTALDH1A1 | |
| SCHEMBL30336754 | 0.76 | KMT2A (0.51) | TSHRKMT2AMAPTALDH1A1LMNA | |
| SCHEMBL2514952 | 0.76 | KMT2A (0.51) | TSHRKMT2AMAPTALDH1A1LMNA |
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-113979955-A | Preparation method of heterocyclic ester compound | 河南农业大学 | 2022-01-28 | — | — | CN | disclosed |