Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TYMP | P19971 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | UPP1 | Q16831 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | KISS1R | Q969F8 | 2/20 | 0.31 |
| ▸ | PNP | P00491 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Acetone SCHEMBL7127311 | 1.00 | LMNA (0.36) | LMNAALDH1A1TYMPCYP2C19HIF1A | |
| Acetone SCHEMBL9233022 | 0.87 | ANPEP (0.41) | LMNAALDH1A1TYMPCYP2C19HIF1A | |
| Acetone SCHEMBL7134016 | 0.87 | UPP1 (0.31) | UPP1 | |
| SCHEMBL14663224 | 0.85 | LMNA (0.44) | LMNAALDH1A1TYMPUPP1KDM4E | |
| Acetic Acid SCHEMBL8948421 | 0.83 | LMNA (0.38) | LMNAALDH1A1TYMPCYP2C19HIF1A | |
| SCHEMBL21691058 | 0.81 | ALDH1A1 (0.36) | LMNAALDH1A1TYMPCYP2C19UPP1 | |
| SCHEMBL18030759 | 0.81 | KDM4E (0.38) | LMNAALDH1A1TYMPUPP1KDM4E | |
| SCHEMBL10470999 | 0.80 | ADRB2 (0.48) | LMNAALDH1A1TYMPCYP2C19HIF1A | |
| SCHEMBL24525596 | 0.79 | TDP1 (0.39) | LMNAALDH1A1TYMPCYP2C19KDM4E | |
| SCHEMBL24017881 | 0.79 | GAA (0.38) | LMNAALDH1A1TYMPCYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0722442-B1 | POLYAZACYCLOALKANES AS DICHELANTS | NYCOMED SALUTAR INC (US) | 2003-01-15 | — | — | EP | disclosed |
| US-5972307-A | ADMINISTERING TO HUMAN OR ANIMAL BODY AN EFFECTIVE AMOUNT OF A DIAGNOSTIC AGENT COMPRISES A METAL CHELATE OF A COMPOUND HAVING TWO MACROCYCLIC CHELANT GROUPS LINKED BY A BRIDGE CONTAINING ESTER OR AMIDE BOND | NYCOMED SALUTAR, INC. (US) | 1999-10-26 | — | — | US | disclosed |
| US-5650133-A | CHELATING AGENTS USEFUL IN DIAGNOSTIC AND THERAPEUTIC COMPOSITIONS | NYCOMED SALUTAR (US) | 1997-07-22 | — | — | US | disclosed |