Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5621510 | 0.88 | CA12 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL1448339 | 0.87 | CA12 (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL20597035 | 0.86 | KDM4E (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL17374970 | 0.85 | CA12 (0.49) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15971290 | 0.85 | CA12 (0.67) | CA12CA1CA2CA7CA9 | |
| SCHEMBL20597311 | 0.82 | TRPV1 (0.43) | CA12CA1CA2CA7CA9 | |
| SCHEMBL16862940 | 0.81 | TDP1 (0.47) | KDM4EHSD17B10SMN1; SMN2TP53HPGD | |
| SCHEMBL160098 | 0.81 | CA12 (0.77) | CA12CA1CA2CA7CA9 | |
| SCHEMBL11398188 | 0.80 | TDP1 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL773633 | 0.79 | TDP1 (0.59) | KDM4EHSD17B10SMN1; SMN2TP53HPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0987254-B1 | NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME | KOWA CO (JP) | 2004-12-22 | — | — | EP | disclosed |
| CN-1118457-C | Cyclic diamine compounds and medicine contg. same | KOWA CO (JP) | 2003-08-20 | — | — | CN | disclosed |
| CN-1258283-A | Cyclic diamine compounds and medicine contg. same | KOWA CO (JP) | 2000-06-28 | — | — | CN | disclosed |
| EP-0987254-A1 | NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME | Kowa Co., Ltd. (JP) | 2000-03-22 | — | — | EP | disclosed |