Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6678513 | 0.82 | TSHR (0.44) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL289488 | 0.75 | ALDH1A1 (0.38) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL9766503 | 0.71 | ALDH1A1 (0.35) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL9370436 | 0.71 | ALDH1A1 (0.35) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL3711104 | 0.70 | CES2 (0.36) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL11593298 | 0.68 | ALDH1A1 (0.36) | ALDH1A1TP53TSHRMEN1CYP1A2 | |
| SCHEMBL20503396 | 0.68 | CYP4F2 (0.40) | ALDH1A1TSHRMEN1CYP1A2THRB | |
| SCHEMBL5325333 | 0.68 | — | — | |
| SCHEMBL8463086 | 0.67 | MMP8 (0.31) | TSHRCYP1A2 | |
| SCHEMBL11430316 | 0.67 | TSHR (0.31) | TSHRCYP1A2CYP2C19 |
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-3137466-A2 | 6-SUBSTITUTED IMIDAZO[1,2-A]PYRAZINECARBOXAMIDES AND USE THEREOF | Bayer Pharma Aktiengesellschaft (DE) | 2017-03-08 | — | — | EP | disclosed |
| WO-2015165933-A2 | 6-SUBSTITUTED IMIDAZO[1,2-A]PYRAZINECARBOXAMIDES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-11-05 | — | — | WO | disclosed |