Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 16/20 | 0.72 |
| ▸ | ABL2 | P42684 | 2/20 | 0.72 |
| ▸ | CSF1R | P07333 | 2/20 | 0.72 |
| ▸ | GAK | O14976 | 1/20 | 0.72 |
| ▸ | MLNR | O43193 | 1/20 | 0.72 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.72 |
| ▸ | JAK2 | O60674 | 1/20 | 0.72 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.72 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.72 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.72 |
| ▸ | EGFR | P00533 | 1/20 | 0.72 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.72 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.72 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.72 |
| ▸ | LCK | P06239 | 1/20 | 0.72 |
| ▸ | FYN | P06241 | 1/20 | 0.72 |
| ▸ | PGR | P06401 | 1/20 | 0.72 |
| ▸ | YES1 | P07947 | 1/20 | 0.72 |
| ▸ | LYN | P07948 | 1/20 | 0.72 |
| ▸ | RET | P07949 | 1/20 | 0.72 |
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 | |
|---|---|---|---|---|
| SCHEMBL25756905 | 0.94 | ABL1 (0.72) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL25756904 | 0.93 | ABL1 (0.71) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL25422487 | 0.92 | ABL1 (0.70) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL25243927 | 0.92 | ABL1 (0.70) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL25756887 | 0.91 | ABL1 (0.59) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL18298082 | 0.88 | ABL1 (0.80) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL31697365 | 0.88 | ABL1 (0.80) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL29888993 | 0.86 | ABL1 (0.78) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL16241445 | 0.86 | ABL1 (0.78) | ABL1ABL2CSF1RGAKMLNR | |
| SCHEMBL18298081 | 0.86 | ABL1 (0.78) | ABL1ABL2CSF1RGAKMLNR |
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-2023119334-A1 | ANTI-CANCER COMPOUND BY COMBINING PONATINIB MOLECULE WITH HDAC INHIBITOR MOLECULE USING A VARIABLE LENGTH LINKER | AMRITA VISHWA VIDYAPEETHAM (IN) | 2023-06-29 | — | — | WO | disclosed |