Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 9/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 4/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL23608226 | 0.90 | TACR1 (0.50) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL14560996 | 0.89 | TACR1 (0.47) | TACR1TSHRSLC1A1CA1CA2 | |
| Hydrochloric Acid SCHEMBL23200830 | 0.89 | TACR1 (0.49) | TACR1TSHRSLC1A1CA1CA2 | |
| Hydrochloric Acid SCHEMBL23200831 | 0.89 | TACR1 (0.49) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL18394417 | 0.86 | TACR1 (0.63) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL3593860 | 0.83 | TACR1 (0.45) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL7967707 | 0.82 | TACR1 (0.59) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL7965700 | 0.82 | TACR1 (0.59) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL2781643 | 0.82 | TACR1 (0.59) | TACR1TSHRSLC1A1CA1CA2 | |
| SCHEMBL9121796 | 0.82 | TACR1 (0.40) | TACR1TSHRSLC1A1CA1CA2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5531978-A | CHELATE COMPOUNDS, IMAGING | NYCOMED IMAGING AS (NO) | 1996-07-02 | — | — | US | disclosed |
| US-5419893-A | Aminopolycarboxylic acids and derivatives thereof for magnetic resonance imaging | NYCOMED IMAGING AS (NO) | 1995-05-30 | — | — | US | disclosed |
| US-5322681-A | Chelating compounds | NYCOMED IMAGING AS (NO) | 1994-06-21 | — | — | US | disclosed |
| US-5198208-A | Chelate compounds for diagnosis by magnetic resonance imaging, ultrasound or radiation therapy | NYCOMED IMAGING AS (NO) | 1993-03-30 | — | — | US | disclosed |
| EP-0299795-B1 | AMINOPOLYCARBOXYLIC ACIDS AND DERIVATIVES THEREOF | NYCOMED AS (NO) | 1992-03-18 | — | — | EP | disclosed |
| EP-0466200-A1 | Aminocarboxylic acids and derivatives thereof | NYCOMED IMAGING AS (NO) | 1992-01-15 | — | — | EP | disclosed |
| EP-0453507-A1 | CHELATING AGENT DERIVATIVES | NYCOMED IMAGING AS (NO) | 1991-10-30 | — | — | EP | disclosed |
| WO-1990008134-A1 | CHELATING AGENT DERIVATIVES | NYCOMED AS (NO) | 1990-07-26 | — | — | WO | disclosed |
| WO-1989000557-A1 | AMINOPOLYCARBOXYLIC ACIDS AND DERIVATIVES THEREOF | COCKBAIN, JULIAN, RODERICK, MICHAELSON (GB) | 1989-01-26 | — | — | WO | disclosed |