Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 2/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | MLYCD | O95822 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP7 | P09237 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11367987 | 0.95 | AHR (0.35) | AHRDPP4ABL1RIN1NAMPT | |
| SCHEMBL11375228 | 0.94 | MLYCD (0.35) | DPP4ABL1RIN1NAMPTMLYCD | |
| SCHEMBL11366088 | 0.93 | AHR (0.34) | AHRDPP4ABL1RIN1NAMPT | |
| SCHEMBL11367998 | 0.93 | CYP1A2 (0.34) | AHRDPP4MLYCDCNR2CYP1A2 | |
| SCHEMBL11375592 | 0.93 | DPP4 (0.35) | AHRDPP4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11376313 | 0.93 | AHR (0.36) | AHRDPP4ABL1RIN1NAMPT | |
| SCHEMBL11372627 | 0.92 | THRB (0.34) | AHRDPP4ABL1RIN1NAMPT | |
| SCHEMBL11367360 | 0.91 | AHR (0.33) | AHRDPP4ABL1RIN1NAMPT | |
| SCHEMBL11378530 | 0.90 | AHR (0.35) | AHRDPP4 | |
| SCHEMBL11368575 | 0.89 | DPP4 (0.34) | DPP4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0000154-B1 | NEW BENZ(F)ISOINDOLINES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | SANDOZ AG (CH) | 1981-07-29 | — | — | EP | disclosed |
| US-4251262-A | 1-Carbamoyl-1,2,4-triazole herbicidal agents | THE BOOTS COMPANY LIMITED (GB) | 1981-02-17 | — | — | US | disclosed |
| EP-0000154-A1 | New benz(f)isoindolines, their preparation and medicaments containing them | SANDOZ AG (CH) | 1979-01-10 | — | — | EP | disclosed |