Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.61 |
| ▸ | FLT4 | P35916 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 5/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | FPR2 | P25090 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29128700 | 1.00 | CDK2 (0.61) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL1193732 | 0.87 | RECQL (0.63) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL30751040 | 0.87 | RECQL (0.63) | CDK2FLT4RAB9AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL21632246 | 0.85 | RECQL (0.61) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL3787099 | 0.84 | CDK2 (0.75) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL3780409 | 0.82 | FLT4 (0.81) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL9637653 | 0.81 | MEN1 (0.77) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL30051982 | 0.81 | MEN1 (0.77) | CDK2FLT4RAB9AMEN1KMT2A | |
| SCHEMBL11541521 | 0.80 | SMN1; SMN2 (0.59) | RAB9AMEN1KMT2AALDH1A1MAPT | |
| Selenium SCHEMBL10544450 | 0.80 | CDK2 (0.68) | CDK2FLT4RAB9AMEN1KMT2A |
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-117263873-A | 1, 4-benzodiazepine compounds and application thereof in preparation of antitumor drugs | 复旦大学 | 2023-12-22 | — | — | CN | disclosed |