Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | BCR | P11274 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13699901 | 0.98 | ABL1 (0.48) | ABL1ABCB1BCRCA12CA9 | |
| SCHEMBL4457722 | 0.84 | ABL1 (0.41) | ABL1ABCB1BCRCA12CA9 | |
| SCHEMBL12603825 | 0.83 | LMNA (0.48) | ABL1ABCB1BCRCA12CA9 | |
| SCHEMBL10304807 | 0.83 | DYRK1A (0.47) | ABL1ABCB1BCRCA12CA9 | |
| SCHEMBL12431134 | 0.81 | HSD17B10 (0.48) | CA12CA9CA1CA2CA7 | |
| SCHEMBL10916725 | 0.81 | HSD17B1 (0.45) | ESR2 | |
| SCHEMBL10304850 | 0.79 | ABL1 (0.42) | ABL1ABCB1BCRCA12CA9 | |
| SCHEMBL13365609 | 0.79 | ABL1 (0.42) | ABL1ABCB1BCRMAPK1NPC1 | |
| SCHEMBL4095554 | 0.78 | HSD17B1 (0.69) | MAPK1NPC1TP53CASP3RAB9A | |
| SCHEMBL28842579 | 0.78 | ABL1 (0.41) | ABL1ABCB1BCRCA12CA9 |
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-1065264-A | The stereoselectivity preparation method of the piperidines that replaces | PFIZER (US) | 1992-10-14 | — | — | CN | disclosed |