Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | MITF | O75030 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 6/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | KDR | P35968 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL14693849 | 0.81 | NPC1 (0.55) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL29030363 | 0.81 | KMT2A (0.51) | MAPTPOLBMEN1KMT2ANPC1 | |
| SCHEMBL25489494 | 0.76 | NPC1 (0.49) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL5221493 | 0.76 | KCNQ3 (0.69) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL29030400 | 0.75 | ALDH1A1 (0.44) | MAPTMAPK1ALDH1A1LMNA | |
| SCHEMBL8572381 | 0.73 | KMT2A (0.83) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL23898948 | 0.73 | KMT2A (0.83) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL9134339 | 0.73 | KMT2A (0.83) | MAPTPOLBMITFMAPK1CYP11B1 | |
| SCHEMBL10940496 | 0.73 | KMT2A (0.71) | MAPTPOLBMITFMAPK1MEN1 | |
| SCHEMBL28259314 | 0.73 | KMT2A (0.71) | MAPTPOLBMITFMAPK1CYP11B1 |
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-116410152-B | Small molecular compound for inhibiting ASCT2, derivative thereof and application thereof | 江苏征瑞医药科技有限公司 | 2023-11-03 | — | — | CN | disclosed |
| CN-116410152-A | Small molecular compound for inhibiting ASCT2, derivative thereof and application thereof | 江苏征瑞医药科技有限公司 | 2023-07-11 | — | — | CN | disclosed |