Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 3/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 2/20 | 0.30 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL28295319 | 1.00 | CYP1A2 (0.40) | CYP1A2KDM4ELMNASMN1; SMN2CHRNB2 | |
| SCHEMBL29046396 | 0.82 | KDM4E (0.41) | CYP1A2KDM4ELMNASMN1; SMN2CHRNB2 | |
| SCHEMBL28966725 | 0.82 | KDM4E (0.41) | CYP1A2KDM4ELMNASMN1; SMN2CHRNB2 | |
| SCHEMBL1455644 | 0.79 | CYP1A2 (0.44) | CYP1A2KDM4ELMNASMN1; SMN2CHRNB2 | |
| SCHEMBL28295317 | 0.79 | CYP1A2 (0.33) | CYP1A2KDM4ELMNASMN1; SMN2GGPS1 | |
| SCHEMBL28767490 | 0.79 | PSEN1 (0.31) | ABCB1 | |
| SCHEMBL28295313 | 0.79 | CYP1A2 (0.33) | CYP1A2KDM4ELMNASMN1; SMN2GGPS1 | |
| SCHEMBL28293534 | 0.75 | CHRNB2 (0.42) | LMNACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL19834192 | 0.70 | CYP2D6 (0.37) | — | |
| SCHEMBL19834191 | 0.70 | CYP2D6 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109790152-A | The diagnosis of neurotensin receptor associated disease treats and prevents | 埃朗根-纽伦堡 弗里德里希-亚历山大大学 | 2019-05-21 | — | — | CN | disclosed |