Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA12 | O43570 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27716518 | 0.83 | ALDH1A1 (0.49) | STAT3CA2CA1CA9CA12 | |
| SCHEMBL973720 | 0.82 | CA1 (0.47) | STAT3CA2CA1CA9CA12 | |
| SCHEMBL4951056 | 0.82 | ALDH1A1 (0.54) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL16897446 | 0.81 | PKM (0.50) | STAT3CA2CA1CA9CA12 | |
| SCHEMBL11794766 | 0.81 | F2 (0.49) | STAT3CA2CA1CA9CA12 | |
| SCHEMBL20085600 | 0.77 | CA1 (0.46) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL3517003 | 0.76 | ALDH1A1 (0.46) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL9247417 | 0.76 | MAPT (0.48) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL3179301 | 0.76 | F2 (0.49) | CA2CA1CA9CA12ALDH1A1 | |
| SCHEMBL7128931 | 0.75 | CA1 (0.56) | CA2CA1CA9CA12ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5763663-A | REACTING 5-HYDROXY-2,4,6-TRIIODO-1,3-BENZENEDICARBOXYLIC ACID DIAMIDE WITH AMIDE HAVING REACTIVE SUBSTITUENT | DIBRA S.P.A. (IT) | 1998-06-09 | — | — | US | disclosed |
| US-5728877-A | ETHERIFICATION OF IODINATED BENZENEDICARBOXYLIC ACID AMIDES, INTERMEDIATES FOR X-RAY CONTRAST MEDIA | DIBRA S.P.A. (IT) | 1998-03-17 | — | — | US | disclosed |