Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.50 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 9/20 | 0.35 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11708761 | 0.87 | HCAR3 (0.48) | GBA1P2RY6AOC3MIFHCAR3 | |
| SCHEMBL11710043 | 0.84 | HCAR3 (0.39) | GBA1P2RY6AOC3MIFHCAR3 | |
| SCHEMBL11708883 | 0.82 | HCAR3 (0.38) | GBA1P2RY6AOC3HCAR3MEN1 | |
| SCHEMBL2889749 | 0.81 | P2RY6 (0.38) | P2RY6MIFCA1CA2HSD17B10 | |
| SCHEMBL13531875 | 0.77 | GBA1 (0.55) | GBA1AOC3MYCHCAR3MEN1 | |
| SCHEMBL1456966 | 0.73 | P2RY6 (0.50) | P2RY6MIFGABRA1GABRB2MEN1 | |
| SCHEMBL11710623 | 0.72 | MAPT (0.45) | P2RY6MIFGABRA1GABRB2MEN1 | |
| SCHEMBL21518466 | 0.71 | ADRA2A (0.50) | P2RY6MIFKMT2ACYP1A2CA1 | |
| SCHEMBL30298639 | 0.71 | ADRA2A (0.50) | P2RY6MIFKMT2ACYP1A2CA1 | |
| SCHEMBL11709850 | 0.70 | NPC1 (0.52) | P2RY6MIFGABRA1GABRB2MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5310724-A | Pre- and postemergence; plant growth regulators | FMC CORPORATION (US) | 1994-05-10 | — | — | US | disclosed |
| US-5108486-A | Herbicides | KANAGAWA CHEMICAL LABORATORY, LTD. (JP) | 1992-04-28 | — | — | US | disclosed |
| US-4001254-A | ISOTHIOCYANOPYRIDINE DERIVATIVES | CIBA-GEIGY CORPORATION (US) | 1977-01-04 | — | — | US | disclosed |