Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 2/20 | 0.42 |
| ▸ | IKBKB | O14920 | 2/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.39 |
| ▸ | GRK6 | P43250 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27318113 | 0.82 | BRD4 (0.42) | GCGRBRD4IKBKBDPP4MEN1 | |
| SCHEMBL9051709 | 0.79 | GCGR (0.44) | GCGRBRD4DHFRDPP4MEN1 | |
| SCHEMBL8027233 | 0.76 | IKBKB (0.43) | BRD4IKBKBMEN1NR1I2LMNA | |
| SCHEMBL28621722 | 0.73 | DHFR (0.49) | GCGRDHFR | |
| SCHEMBL4301700 | 0.73 | GCGR (0.43) | GCGRBRD4DPP4MEN1NR1I2 | |
| SCHEMBL10903924 | 0.72 | CYP3A4 (0.48) | GCGRMEN1NR1I2LMNACHRM2 | |
| SCHEMBL5370893 | 0.71 | CYP3A4 (0.53) | MEN1NR1I2LMNACHRM2CYP3A4 | |
| SCHEMBL11323683 | 0.70 | RARB (0.49) | GCGRRARB | |
| SCHEMBL2882017 | 0.70 | DHFR (0.52) | GCGRDHFRCNR2 | |
| SCHEMBL7060341 | 0.70 | DHFR (0.52) | GCGRDHFRCNR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0722439-A1 | HIV PROTEASE INHIBITORS | AGOURON PHARMACEUTICALS, INC. (US) | 1996-07-24 | — | — | EP | disclosed |