Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 5/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.35 |
| ▸ | MMP9 | P14780 | 2/20 | 0.35 |
| ▸ | MMP13 | P45452 | 2/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945805 | 0.91 | MMP8 (0.38) | MMP8MMP1MMP9MMP13RIPK1 | |
| SCHEMBL8946105 | 0.71 | RIPK1 (0.38) | MMP8MMP1MMP9MMP13RIPK1 | |
| SCHEMBL8761086 | 0.68 | CYP3A4 (0.64) | MMP8MMP1MMP9MMP13ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9482605 | 0.68 | SLC6A2 (0.39) | MMP8MMP1MMP9MMP13NPC1 | |
| SCHEMBL8761288 | 0.66 | SLC6A2 (0.50) | MMP1MMP9MMP13ALDH1A1RECQL | |
| Maleic Acid SCHEMBL9482672 | 0.66 | TAAR1 (0.44) | MMP1MMP9MMP13ALDH1A1RECQL | |
| Fumaric Acid SCHEMBL9482681 | 0.66 | TAAR1 (0.44) | MMP1MMP9MMP13ALDH1A1RECQL | |
| SCHEMBL8945878 | 0.65 | RIPK1 (0.39) | MMP8MMP1MMP9MMP13RIPK1 | |
| Fumaric Acid SCHEMBL8760258 | 0.64 | CYP3A4 (0.57) | MMP1MMP9MMP13ALDH1A1NPC1 | |
| SCHEMBL29648088 | 0.63 | CYP2D6 (0.59) | ALDH1A1HTR1ACYP2D6SCN1ASLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5510346-A | ANTIDEPRESSANTS, ANTIANXIETY AGENTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-04-23 | — | — | US | disclosed |