Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4954449 | 0.89 | HRH3 (0.47) | HRH3PTGES2KMT2AMAPTHAO1 | |
| SCHEMBL31257852 | 0.81 | CA12 (0.44) | GRM5ALDH1A1CYP2A6CA12CA2 | |
| SCHEMBL14268091 | 0.81 | ASIC3 (0.49) | GRM5ALDH1A1CYP2A6CA12CA2 | |
| SCHEMBL507497 | 0.78 | KIF11 (0.48) | ALDH1A1CYP2A6HRH3CA12CA2 | |
| SCHEMBL13597759 | 0.78 | HRH3 (0.41) | GRM5HRH3PTGES2ACHEFFAR1 | |
| SCHEMBL24722261 | 0.78 | HRH3 (0.41) | HRH3PTGES2KMT2AMAPTHAO1 | |
| SCHEMBL4379793 | 0.78 | APP (0.48) | ALDH1A1HRH3CA12CA2CA9 | |
| SCHEMBL20717544 | 0.78 | APP (0.59) | ALDH1A1HRH3PTGES2ACHETDP1 | |
| SCHEMBL22881118 | 0.78 | HRH3 (0.41) | ALDH1A1CYP2A6HRH3PTGES2KMT2A | |
| SCHEMBL6744783 | 0.78 | HRH3 (0.41) | HRH3PTGES2KMT2AMAPTHAO1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5112851-A | Agricultural Fungicides | SANDOZ LTD. (CH) | 1992-05-12 | — | — | US | disclosed |
| US-4939148-A | Amine derivatives, processes for their production and their use | SANDOZ, LTD. (CH) | 1990-07-03 | — | — | US | disclosed |