Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.46 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11593236 | 0.92 | CYP1A2 (0.53) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL31618323 | 0.91 | CYP1A2 (0.56) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL25623837 | 0.91 | TSHR (0.46) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL27911992 | 0.88 | ALDH1A1 (0.47) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL25475206 | 0.87 | KMT2A (0.46) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL11021089 | 0.87 | SIGMAR1 (0.48) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL18232025 | 0.87 | SIGMAR1 (0.44) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL26784847 | 0.87 | KMT2A (0.47) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL23871039 | 0.87 | KMT2A (0.46) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A | |
| SCHEMBL12120100 | 0.87 | ALDH1A1 (0.49) | SIGMAR1CYP1A2CYP2D6TSHRKMT2A |
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-4094976-A | ANTICOCCIDIAL CYCLICAMINO ETHANOLS AND ESTERS THEREOF | MERCK & CO., INC. (US) | 1978-06-13 | — | — | US | disclosed |