Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.51 |
| ▸ | PGR | P06401 | 2/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4507525 | 0.88 | AKR1B1 (0.51) | AKR1B1PGRCAPN9CASP3CYP3A4 | |
| SCHEMBL31419434 | 0.81 | PGR (0.58) | AKR1B1PGRCAPN9CASP3CYP3A4 | |
| SCHEMBL2144672 | 0.81 | PGR (0.58) | AKR1B1PGRCAPN9CASP3CYP3A4 | |
| SCHEMBL5803126 | 0.76 | AKR1B1 (0.51) | AKR1B1PGRCAPN9CASP3CYP3A4 | |
| SCHEMBL5561847 | 0.76 | PGR (0.46) | AKR1B1PGRCYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL31079959 | 0.74 | MEN1 (0.45) | AKR1B1PGRADRA2APNMTADRA2B | |
| SCHEMBL2242471 | 0.74 | MEN1 (0.45) | AKR1B1PGRADRA2APNMTADRA2B | |
| SCHEMBL13088966 | 0.74 | PGR (0.44) | PGRALDH1A1 | |
| SCHEMBL13732230 | 0.74 | PGR (0.58) | AKR1B1PGR | |
| SCHEMBL14690967 | 0.74 | SNCA (0.50) | AKR1B1PGRADRA2APNMTADRA2B |
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-85103724-B | Process for preparing pyrrolobenzimidazoles | 曼海姆伯灵格股份公司 | 1988-07-06 | — | — | CN | disclosed |
| CN-85103724-A | The method for preparing novel pyrrolo-benzoglyoxaline | — | 1986-07-02 | — | — | CN | disclosed |