Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | HPGDS | O60760 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6859151 | 0.81 | MMP1 (0.45) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL28858282 | 0.77 | MMP1 (0.47) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL6383050 | 0.77 | MMP1 (0.47) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL1616681 | 0.74 | MMP1 (0.51) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL2464311 | 0.73 | MMP1 (0.44) | MMP1MMP2MMP9MMP12CES2 | |
| SCHEMBL1036006 | 0.72 | — | — | |
| SCHEMBL1254648 | 0.72 | — | — | |
| SCHEMBL5166429 | 0.72 | — | — | |
| SCHEMBL3876236 | 0.72 | CES2 (0.46) | CES2CES1MAPTMEN1NPC1 | |
| SCHEMBL29173876 | 0.72 | MMP1 (0.46) | MMP1MMP2MMP9MMP12CES2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005061655-A1 | USE OF GADOLINIUM(III) CHELATES AS LUMINESCENT MATERIALS IN ORGANIC LIGHT-EMITTING DIODES (OLEDS) | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-07 | — | — | WO | disclosed |