Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.64 |
| ▸ | CA12 | O43570 | 1/20 | 0.64 |
| ▸ | CA1 | P00915 | 1/20 | 0.64 |
| ▸ | CA7 | P43166 | 1/20 | 0.64 |
| ▸ | CA9 | Q16790 | 1/20 | 0.64 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.57 |
| ▸ | NQO1 | P15559 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.50 |
| ▸ | TUBB | P07437 | 1/20 | 0.50 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.50 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.50 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.50 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.50 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19612211 | 0.94 | KDM4E (0.61) | CA2CA12CA1CA7CA9 | |
| SCHEMBL28891596 | 0.87 | KDM4E (0.50) | CA2CA12CA1CA7CA9 | |
| SCHEMBL12093645 | 0.85 | CA12 (0.68) | CA2CA12CA1CA7CA9 | |
| SCHEMBL8888440 | 0.85 | CA12 (0.68) | CA2CA12CA1CA7CA9 | |
| SCHEMBL27799760 | 0.84 | CA2 (0.55) | CA2CA12CA1CA7CA9 | |
| SCHEMBL7013648 | 0.84 | HIF1A (0.49) | CA2CA12CA1CA7CA9 | |
| SCHEMBL7013645 | 0.84 | HIF1A (0.49) | CA2CA12CA1CA7CA9 | |
| SCHEMBL16953203 | 0.83 | ALDH1A1 (0.56) | CA2CA12CA1CA7CA9 | |
| SCHEMBL15450963 | 0.83 | CA2 (0.59) | CA2CA12CA1CA7CA9 | |
| SCHEMBL13256249 | 0.83 | NQO1 (0.50) | CA2CA12CA1CA7CA9 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1863763-A | Inhibitors of semicarbazide-sensitive amine oxidase (SSAO) and VAP-1 mediated adhesion for the treatment of disease | JOLLA PHARMA (US) | 2006-11-15 | — | — | CN | disclosed |
| CN-1184423-A | Nodulisporic acid derivatives | MERCK & CO INC (US) | 1998-06-10 | — | — | CN | disclosed |
| EP-0500530-A1 | CATALYST COMPONENT FOR MAKING PRIMARILY ISOTACTIC ELASTOMERIC POLYPROPYLENE OR POLYBUTENE. | SHELL OIL CO (US) | 1992-09-02 | — | — | EP | disclosed |
| EP-0500530-A4 | CATALYST COMPONENT FOR MAKING PRIMARILY ISOTACTIC ELASTOMERIC POLYPROPYLENE OR POLYBUTENE. | SHELL OIL CO (US) | 1992-05-14 | — | — | EP | disclosed |
| US-4029699-A | CHOLERETIC ACTIVITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-06-14 | — | — | US | disclosed |
| US-4017517-A | SPASMOLYTIC, CHOLERETIC | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-04-12 | — | — | US | disclosed |
| US-3946040-A | JUVENILE HORMONE ACTIVITY, INSECTICIDES | HOFFMANN-LA ROCHE INC. (US) | 1976-03-23 | — | — | US | disclosed |
| US-3943169-A | DIURETIC, SPASMOLYTIC | TAKEDA CHEMICAL INDUSTRIES, LTD (JA) | 1976-03-09 | — | — | US | disclosed |