Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 17/20 | 0.43 |
| ▸ | CA2 | P00918 | 17/20 | 0.43 |
| ▸ | CA4 | P22748 | 9/20 | 0.43 |
| ▸ | CA12 | O43570 | 5/20 | 0.43 |
| ▸ | CA9 | Q16790 | 5/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 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 | |
|---|---|---|---|---|
| SCHEMBL8719328 | 0.92 | TDP1 (0.56) | CA1CA2CA4CA12CA9 | |
| SCHEMBL15499780 | 0.92 | TDP1 (0.56) | CA1CA2CA4CA12CA9 | |
| SCHEMBL21539283 | 0.92 | TDP1 (0.56) | CA1CA2CA4CA12CA9 | |
| Water SCHEMBL8536223 | 0.91 | TDP1 (0.54) | CA1CA2CA4CA12CA9 | |
| SCHEMBL18650771 | 0.90 | CA1 (0.38) | CA1CA2CA4CA12CA9 | |
| SCHEMBL13913072 | 0.88 | CA1 (0.37) | CA1CA2CA4CA12CA9 | |
| SCHEMBL1913870 | 0.88 | ALOX15 (0.39) | CA1CA2CA4CA12CA9 | |
| SCHEMBL9393098 | 0.88 | CA1 (0.41) | CA1CA2CA4CA12CA9 | |
| SCHEMBL17897098 | 0.85 | CA1 (0.47) | CA1CA2CA4CA12CA9 | |
| SCHEMBL2028359 | 0.85 | CASP2 (0.50) | — |
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-0345723-B1 | Diethylenetriamine pentaacetic acid derivatives | NIHON MEDIPHYSICS CO LTD (JP) | 1994-05-25 | — | — | EP | disclosed |
| US-5250702-A | Nonradioactive carriers for radioactive metal elements | NIHON MEDI-PHYSICS CO., LTD. (JP) | 1993-10-05 | — | — | US | disclosed |
| US-5094950-A | Diagnostics | NIHON MEDI-PHYSICS CO., LTD. (JP) | 1992-03-10 | — | — | US | disclosed |
| EP-0345723-A2 | Diethylenetriamine pentaacetic acid derivatives | NIHON MEDI-PHYSICS CO., LTD. (JP) | 1989-12-13 | — | — | EP | disclosed |