Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GGPS1 | O95749 | 1/20 | 0.56 |
| ▸ | IDO1 | P14902 | 3/20 | 0.55 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10934006 | 0.82 | IDO1 (0.59) | GGPS1IDO1NR4A2L3MBTL1HDAC8 | |
| SCHEMBL27759848 | 0.79 | IDO1 (0.53) | IDO1NR4A2L3MBTL1HDAC8MAPT | |
| SCHEMBL9693335 | 0.78 | TDP1 (0.51) | GGPS1IDO1NR4A2L3MBTL1HDAC8 | |
| SCHEMBL12858987 | 0.76 | GGPS1 (0.61) | GGPS1IDO1HTTALDH1A1CYP1A2 | |
| SCHEMBL20378230 | 0.76 | GGPS1 (0.61) | GGPS1IDO1NR4A2HTTALDH1A1 | |
| SCHEMBL5079167 | 0.75 | IDO1 (0.64) | GGPS1IDO1NR4A2L3MBTL1HDAC8 | |
| SCHEMBL29984975 | 0.74 | IDO1 (0.69) | GGPS1IDO1NR4A2L3MBTL1GAA | |
| SCHEMBL165560 | 0.74 | IDO1 (0.69) | GGPS1IDO1NR4A2L3MBTL1GAA | |
| SCHEMBL7888003 | 0.74 | IDO1 (0.69) | GGPS1IDO1NR4A2L3MBTL1GAA | |
| SCHEMBL12786033 | 0.73 | TSHR (0.48) | IDO1NR4A2L3MBTL1HDAC8GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4845279-A | Method of preparing 4-trifluoromethyl-2-nitrobenzoic acid and novel isomer | CENTRAL GLASS COMPANY, LIMITED (JP) | 1989-07-04 | — | — | US | claimed |
| US-4804785-A | INTERMEDIATES FOR HYDROXYMETHYLOXIRANES | BASF AKTIENGESELLSCHAFT (DE) | 1989-02-14 | — | — | US | disclosed |
| US-4723042-A | REARRANGEMENT OF AN OXYKETONE USING A PHOSPHORUS COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 1988-02-02 | — | — | US | disclosed |