Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8689817 | 0.99 | CA12 (0.55) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL2735969 | 0.86 | CA12 (0.72) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL7877575 | 0.80 | KDM4E (0.59) | KDM4EALDH1A1GAAMAPK1NPC1 | |
| Hydrochloric Acid SCHEMBL3926581 | 0.80 | IDO1 (0.52) | CA12CA1CA2CA9KDM4E | |
| Hydrochloric Acid SCHEMBL7882333 | 0.79 | KDM4E (0.57) | KDM4EALDH1A1GAAMAPK1NPC1 | |
| SCHEMBL8227820 | 0.78 | ITGB3 (0.69) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL13587037 | 0.78 | HDAC2 (0.67) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL6657027 | 0.77 | HDAC2 (0.67) | CA12CA1CA2CA9KDM4E | |
| SCHEMBL14269112 | 0.77 | IDO1 (0.65) | KDM4EALDH1A1GAAMAPK1IDO1 | |
| SCHEMBL1952751 | 0.76 | KDM4E (0.67) | KDM4EALDH1A1GAAMAPK1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1136038-A | Indoloylguanidine derivatives | SUMITOMO PHARMACEUTICS K K (JP) | 1996-11-20 | — | — | CN | disclosed |
| CN-1106800-A | Indoloylguanidine derivatives | SUMITOMO PHARMA (JP) | 1995-08-16 | — | — | CN | disclosed |