Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 5/20 | 0.35 |
| ▸ | MAOA | P21397 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22485593 | 0.84 | GRM5 (0.51) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL19583155 | 0.81 | GRM5 (0.57) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL14269510 | 0.81 | GRM5 (0.49) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL5982497 | 0.77 | MAOB (0.53) | GRM5CA12CA2CA9MAOB | |
| SCHEMBL304704 | 0.77 | MAOB (0.47) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL6929485 | 0.77 | CA12 (0.47) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL6830597 | 0.77 | GRM5 (0.45) | GRM5CA12CA2CA9PPARG | |
| SCHEMBL8331446 | 0.74 | TSHR (0.53) | MEN1KMT2ATAAR1TSHRCYP3A4 | |
| SCHEMBL2201285 | 0.72 | CA12 (0.50) | GRM5CA12CA2CA9MEN1 | |
| SCHEMBL11044440 | 0.72 | CA12 (0.50) | CA12CA2CA9MEN1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6005058-A | Polydiacetylenes exhibiting extended wavelength absorption maxima | UNIVERSITY OF MASSACHUSETTS LOWELL (US) | 1999-12-21 | — | — | US | disclosed |