Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | P2RY4 | P51582 | 8/20 | 0.43 |
| ▸ | P2RY12 | Q9H244 | 4/20 | 0.43 |
| ▸ | P2RY2 | P41231 | 3/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.43 |
| ▸ | P2RY6 | Q15077 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9846540 | 0.80 | MAPT (0.53) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL595104 | 0.78 | P2RY12 (0.56) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL11798486 | 0.78 | P2RY4 (0.46) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL14600814 | 0.77 | P2RY12 (0.55) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL11063817 | 0.77 | DHODH (0.60) | CYP1A2LMNAMAPK1MAPTMEN1 | |
| SCHEMBL11797485 | 0.75 | PTPN1 (0.49) | CYP1A2TSHRP2RY4P2RY12P2RY2 | |
| SCHEMBL11605977 | 0.75 | P2RY12 (0.57) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL10622852 | 0.74 | MAPT (0.60) | CYP1A2TSHRLMNAMAPK1MAPT | |
| SCHEMBL24174948 | 0.72 | CYP2A6 (0.45) | CYP1A2LMNAMAPTKMT2ATDP1 | |
| SCHEMBL35556 | 0.72 | P2RY2 (0.60) | CYP1A2TSHRLMNAMAPK1MAPT |
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-3998780-A | Bis-(polyhalogenoanilino)-anthraquinones | CIBA-GEIGY CORPORATION (US) | 1976-12-21 | — | — | US | disclosed |