Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20503163 | 0.69 | KMT2A (0.41) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL262950 | 0.69 | KMT2A (0.34) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL10692329 | 0.67 | KMT2A (0.47) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL5545766 | 0.66 | CYP1A2 (0.41) | KMT2ARAB9ASMN1; SMN2ALDH1A1CA12 | |
| SCHEMBL1356205 | 0.65 | TSHR (0.41) | KMT2ARAB9AALDH1A1CA12CA1 | |
| SCHEMBL9533952 | 0.65 | CES1 (0.40) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL2774081 | 0.64 | NPC1 (0.44) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL27780014 | 0.64 | CES1 (0.52) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL1010019 | 0.64 | CA12 (0.35) | RAB9ASMN1; SMN2ALDH1A1MAPK1CA12 | |
| SCHEMBL7202399 | 0.64 | ALDH1A1 (0.46) | KMT2ARAB9ASMN1; SMN2ALDH1A1MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5986074-A | CHELATE COMPOUNDS AS IMAGING AGENTS AND KITS | EMORY UNIVERSITY (US) | 1999-11-16 | — | — | US | disclosed |
| US-5955053-A | TECHNETIUM OR RHENIUM CHELATES WITH LIGANDS SUCH AS DITHIOUREA, CYSTEINYLETHYLENE OR THIOACETAMIDETHIOUREA FOR IMAGES | EMORY UNIVERSITY (US) | 1999-09-21 | — | — | US | disclosed |
| EP-0542216-A1 | Diaminomercapto (thio)ethers as complexing agents for nucleides applicable in nuclear medicine, process for the preparation of this complexes, and masking kits containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-05-19 | — | — | EP | disclosed |