Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | CD38 | P28907 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2404117 | 0.78 | CYP3A4 (0.45) | CYP11B1CYP11B2KMT2ACYP1A2CYP3A4 | |
| SCHEMBL7870381 | 0.78 | CYP1A2 (0.50) | GAAKMT2ASMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL27641960 | 0.76 | KIF11 (0.50) | GAAKMT2AMAPTHTTNPSR1 | |
| SCHEMBL13164564 | 0.71 | CYP1A2 (0.56) | CYP11B1CYP11B2GAAKMT2ASMN1; SMN2 | |
| Piperazine SCHEMBL4470401 | 0.70 | CYP26A1 (0.39) | CYP11B1CYP11B2KMT2ACYP1A2CYP3A4 | |
| M-Xylene SCHEMBL29245042 | 0.69 | NFKB1 (0.60) | CYP11B1CYP11B2GAACD38KMT2A | |
| SCHEMBL872242 | 0.67 | IDO1 (0.64) | CYP11B1CYP11B2KMT2ACYP3A4MAPT | |
| SCHEMBL2574204 | 0.67 | HTT (0.42) | GAAKMT2ASMN1; SMN2PKMCYP1A2 | |
| SCHEMBL10569930 | 0.66 | NPSR1 (0.70) | GAAKMT2ASMN1; SMN2PKMCYP1A2 | |
| SCHEMBL5991144 | 0.66 | NOS1 (0.44) | CD38CYP26A1FLT1KDR |
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-1370539-A1 | HIV INHIBITING N-AMINOIMIDAZOLE DERIVATIVES | K.U. Leuven Research and Development (BE) | 2003-12-17 | — | — | EP | disclosed |
| WO-2002068395-A1 | HIV INHIBITING N-AMINOIMIDAZOLE DERIVATIVES | K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) | 2002-09-06 | — | — | WO | disclosed |