Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 7/20 | 0.68 |
| ▸ | MEN1 | O00255 | 4/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.68 |
| ▸ | MAPT | P10636 | 4/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.68 |
| ▸ | NPC1 | O15118 | 2/20 | 0.68 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.49 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.47 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6887875 | 0.89 | AKR1B1 (0.56) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6879204 | 0.86 | AKR1B1 (0.70) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6879207 | 0.86 | AKR1B1 (0.70) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6887657 | 0.86 | MAPT (0.56) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6887580 | 0.85 | AKR1B1 (0.67) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL7537933 | 0.83 | MAPT (0.80) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL4863223 | 0.83 | MAPT (0.80) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL10492259 | 0.81 | MAPT (1.00) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL1315178 | 0.81 | MAPT (1.00) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6887148 | 0.81 | MAPT (0.73) | AKR1B1MEN1KMT2AMAPTALDH1A1 |
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-6673816-B1 | Rhodanine carboxylic acid derivatives for the treatment and prevention of metabolic bone disorders | Esswein, Angelika (DE) | 2004-01-06 | — | — | US | disclosed |
| EP-1117655-A1 | RHODANINE CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS | Esswein, Angelika (DE) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000018747-A1 | RHODANINE CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS | ROCHE DIAGNOSTICS GMBH (DE) | 2000-04-06 | — | — | WO | disclosed |