Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 3/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.41 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | S100A4 | P26447 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8480733 | 0.71 | KDM4E (0.36) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL29757278 | 0.71 | KDM4E (0.36) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| Oxalic Acid SCHEMBL10499933 | 0.68 | MEN1 (0.32) | KDM4EMEN1KMT2AALDH1A1POLB | |
| Acetic Acid SCHEMBL25341096 | 0.67 | TRPA1 (0.31) | KDM4ELMNAMEN1KMT2AALDH1A1 | |
| Methylene Chloride SCHEMBL27481165 | 0.67 | KDM4E (0.33) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9268154 | 0.66 | KDM4E (0.33) | TSHRKDM4ELMNAMEN1KMT2A | |
| SCHEMBL27510614 | 0.66 | — | — | |
| SCHEMBL19774414 | 0.65 | CDC25B (0.72) | CDC25BIDO1MAOAMAOBAKT1 | |
| Fumaric Acid SCHEMBL11602682 | 0.65 | ALDH1A1 (0.38) | PKMKDM4ELMNAMEN1KMT2A | |
| SCHEMBL19859257 | 0.64 | LMNA (0.36) | TDP1ALOX15TSHRKDM4ELMNA |
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-114828964-A | KRAS G12C inhibitors | 伊莱利利公司 | 2022-07-29 | — | — | CN | disclosed |