Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8532755 | 0.98 | CYP1A2 (0.43) | CYP1A2CYP2C9CYP2C19SLC15A1MAPK1 | |
| SCHEMBL8532864 | 0.94 | CYP1A2 (0.40) | CYP1A2CYP2C9CYP2C19SLC15A1MAPK1 | |
| SCHEMBL8533380 | 0.92 | CYP2C9 (0.42) | CYP1A2CYP2C9CYP2C19SLC15A1MAPK1 | |
| SCHEMBL8531280 | 0.91 | MCL1 (0.46) | SLC15A1MAPK1ALDH1A1L3MBTL1MCL1 | |
| SCHEMBL8533053 | 0.90 | DHODH (0.46) | SLC15A1ALDH1A1L3MBTL1MCL1RAB9A | |
| SCHEMBL8796844 | 0.86 | POLB (0.43) | MCL1RAB9ANPC1MGLLPOLB | |
| SCHEMBL8531978 | 0.86 | MCL1 (0.45) | MAPK1ALDH1A1L3MBTL1MCL1SMN1; SMN2 | |
| SCHEMBL8530651 | 0.85 | DHODH (0.45) | ALDH1A1L3MBTL1RAB9ANPC1MAPT | |
| SCHEMBL7449992 | 0.80 | ALDH1A1 (0.45) | CYP1A2CYP2C9CYP2C19SLC15A1MAPK1 | |
| Hydrochloric Acid SCHEMBL7455276 | 0.79 | ALDH1A1 (0.44) | CYP1A2CYP2C9CYP2C19SLC15A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5773428-A | BONE DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1998-06-30 | — | — | US | disclosed |
| WO-1996023791-A1 | BRIDGED INDOLES AS MATRIX METALLOPROTEASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1996-08-08 | — | — | WO | disclosed |