Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.49 |
| ▸ | METAP2 | P50579 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.39 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL12978 | 0.73 | CYP1A2 (0.67) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL3766697 | 0.72 | RAB9A (0.73) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL4546968 | 0.70 | RAB9A (0.70) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL12127292 | 0.69 | IDO1 (0.50) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL5548164 | 0.69 | RAB9A (0.49) | IDO1METAP2RAB9ACASP3SENP7 | |
| SCHEMBL29417890 | 0.69 | IDO1 (0.50) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL12367 | 0.69 | GP6 (0.66) | CYP2C9IDO1METAP2RAB9AMAPT | |
| SCHEMBL4546940 | 0.69 | RAB9A (0.68) | CYP1A2CYP2C9IDO1METAP2RAB9A | |
| SCHEMBL4391847 | 0.69 | RAB9A (0.57) | IDO1METAP2RAB9ANISCHTP53 | |
| SCHEMBL29373699 | 0.68 | ACHE (0.69) | IDO1METAP2RAB9ANISCHNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0201459-A1 | Acylaminomethyl-penem compounds, their preparation and pharmaceutical formulations containing them | CIBA-GEIGY AG (CH) | 1986-11-12 | — | — | EP | disclosed |
| EP-0112283-A1 | Heterocyclyl-thio compounds, process for their preparation, pharmaceutical compositions containing them and their use | CIBA-GEIGY AG (CH) | 1984-06-27 | — | — | EP | disclosed |