Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 2/20 | 0.55 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.55 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.55 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 9/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.48 |
| ▸ | NPC1 | O15118 | 8/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.48 |
| ▸ | RELA | Q04206 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | STAT3 | P40763 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27262488 | 0.99 | CASP3 (0.54) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL27263353 | 0.99 | CASP3 (0.54) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL27262965 | 0.99 | CASP3 (0.54) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL27262428 | 0.99 | CASP3 (0.54) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL27263461 | 0.96 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL9345831 | 0.90 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL9343400 | 0.90 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL9346712 | 0.90 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL9341801 | 0.90 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A | |
| SCHEMBL10337555 | 0.90 | RAB9A (0.52) | CASP3SENP8SENP7SENP6RAB9A |
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-1023699-C | Difluoromethyl compounds | MERCK PATENT GMBH (DE) | 1994-02-09 | — | — | CN | disclosed |
| CN-1039797-A | difluoromethyl compound | MERCK PATENT GMBH (DE) | 1990-02-21 | — | — | CN | disclosed |