Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5127007 | 0.86 | LMNA (0.55) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL15855842 | 0.84 | NPC1 (0.51) | TSHRLMNACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL5012257 | 0.81 | TSHR (0.53) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5117500 | 0.81 | ALDH1A1 (0.55) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5129693 | 0.80 | ALDH1A1 (0.61) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5131413 | 0.80 | PKM (0.50) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5011540 | 0.78 | ALDH1A1 (0.47) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5128772 | 0.78 | PKM (0.50) | TSHRLMNACYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL5121286 | 0.77 | SMN1; SMN2 (0.55) | TSHRLMNACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL16175757 | 0.76 | ALDH1A1 (0.53) | TSHRLMNACYP1A2CYP3A4CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1888596-B1 | SUBSTITUTED SPIRO COMPOUNDS AND THEIR USE FOR PRODUCING PAIN-RELIEF MEDICAMENTS | GRUENENTHAL GMBH (DE) | 2014-10-22 | — | — | EP | claimed |