Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8085012 | 0.87 | CNR2 (0.52) | CNR2KMT2ANPC1ABCB1ABCC1 | |
| SCHEMBL10656628 | 0.77 | KMT2A (0.71) | KMT2ANPC1ABCB1ABCC1ALDH1A1 | |
| SCHEMBL5444112 | 0.74 | HTR1A (0.50) | KMT2ANPC1ABCB1ABCC1ALDH1A1 | |
| SCHEMBL11385360 | 0.74 | KMT2A (0.62) | KMT2ANPC1ABCB1ABCC1ALDH1A1 | |
| SCHEMBL4411460 | 0.71 | CNR2 (0.51) | CNR2KMT2ANPC1ABCB1ALDH1A1 | |
| SCHEMBL4405456 | 0.70 | CNR2 (0.76) | CNR2ABCB1LMNAKCNJ1KCNH2 | |
| Hydrochloric Acid SCHEMBL11280074 | 0.70 | ABCB1 (0.71) | KMT2ANPC1ABCB1ABCC1KCNJ1 | |
| SCHEMBL8790430 | 0.70 | ABCG2 (0.59) | ABCB1KCNJ1KCNH2SIGMAR1 | |
| SCHEMBL8086146 | 0.68 | CNR2 (0.47) | CNR2ABCB1LMNAKCNJ1KCNH2 | |
| SCHEMBL8790577 | 0.68 | ABCB1 (0.62) | KMT2ANPC1ABCB1ABCC1ALDH1A1 |
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-6017919-A | Compounds and pharmaceutical use thereof | JAPAN TOBACCO INC. (JP) | 2000-01-25 | — | — | US | disclosed |
| EP-0887340-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL USE THEREOF | Japan Tobacco Inc. (JP) | 1998-12-30 | — | — | EP | disclosed |