Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MYLK | Q15746 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 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 | |
|---|---|---|---|---|
| SCHEMBL493231 | 0.80 | TSHR (1.00) | TSHRKMT2ALMNAMAPK1MAPT | |
| SCHEMBL31684036 | 0.80 | TSHR (1.00) | TSHRKMT2ALMNAMAPK1MAPT | |
| SCHEMBL27758825 | 0.74 | TSHR (0.44) | TSHRKMT2AMAPTSMN1; SMN2CYP3A4 | |
| SCHEMBL4001953 | 0.73 | TSHR (0.72) | TSHRKMT2ALMNAMAPK1MAPT | |
| SCHEMBL4821352 | 0.71 | KMT2A (0.47) | KMT2ALMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL5915288 | 0.70 | L3MBTL1 (0.54) | KMT2ALMNAMAPK1MAPTSMN1; SMN2 | |
| SCHEMBL293776 | 0.69 | ALDH1A1 (0.51) | TSHRLMNACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6448521 | 0.69 | KMT2A (0.63) | TSHRKMT2ALMNAMAPK1SMN1; SMN2 | |
| SCHEMBL2960625 | 0.68 | TSHR (0.65) | TSHRKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL1248188 | 0.67 | AKR1B1 (0.56) | TSHRKMT2ALMNAHTR6ALDH1A1 |
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-2155678-A1 | NEW BRADYKININ B1 ANTAGONISTS | EVOTEC Neurosciences GmbH (DE) | 2010-02-24 | — | — | EP | disclosed |
| WO-2008125570-A1 | NEW BRADYKININ B1 ANTAGONISTS | EVOTEC NEUROSCIENCES GMBH (DE) | 2008-10-23 | — | — | WO | disclosed |