Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL4094207 | 0.77 | MEN1 (0.53) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL9906204 | 0.73 | MEN1 (0.52) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL10683290 | 0.73 | ALDH1A1 (0.65) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL29168805 | 0.72 | ALDH1A1 (0.48) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL598734 | 0.71 | MEN1 (0.55) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL7035347 | 0.70 | TSHR (0.65) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL6801249 | 0.69 | ALDH1A1 (0.77) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL17793710 | 0.69 | KMT2A (0.61) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL12478115 | 0.69 | KMT2A (0.57) | MEN1KMT2ARAB9AALDH1A1MAPT | |
| SCHEMBL10737899 | 0.68 | TRPV4 (0.49) | CA9CA2CA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2004642-A1 | BIFUNCTIONAL POLYAZAMACROCYCLIC CHELATING AGENTS | MDS (Canada) Inc. (CA) | 2008-12-24 | — | — | EP | disclosed |
| WO-2007104135-A1 | BIFUNCTIONAL POLYAZAMACROCYCLIC CHELATING AGENTS | MDS (CANADA) INC. (CA) | 2007-09-20 | — | — | WO | disclosed |