Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6431806 | 0.81 | ALDH1A1 (0.36) | ALDH1A1LMNAPOLBHPGDGAA | |
| SCHEMBL6947779 | 0.72 | TSHR (0.39) | ALDH1A1LMNAPOLBHPGDGAA | |
| SCHEMBL12156215 | 0.68 | ALDH1A1 (0.46) | ALDH1A1LMNAPOLBHPGDGAA | |
| Acetic Acid SCHEMBL137819 | 0.68 | ALDH1A1 (0.50) | ALDH1A1LMNAPOLBTSHRKDM4E | |
| Acetic Acid SCHEMBL9328243 | 0.68 | ALDH1A1 (0.50) | ALDH1A1LMNAPOLBTSHRKDM4E | |
| SCHEMBL6431570 | 0.68 | HTR1A (0.40) | ALDH1A1LMNAKDM4E | |
| SCHEMBL22996262 | 0.65 | ALDH1A1 (0.43) | ALDH1A1LMNAPOLBHPGDGAA | |
| SCHEMBL10465693 | 0.65 | ALDH1A1 (0.43) | ALDH1A1LMNAPOLBHPGDGAA | |
| SCHEMBL5677281 | 0.65 | ALDH1A1 (0.43) | ALDH1A1LMNAPOLBHPGDGAA | |
| SCHEMBL2321115 | 0.65 | ALDH1A1 (0.39) | ALDH1A1LMNAPOLBHPGDGAA |
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-1126838-A4 | NITROSATED AND NITROSYLATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE | NITROMED INC (US) | 2005-02-16 | — | — | EP | disclosed |
| EP-1126838-A1 | NITROSATED AND NITROSYLATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE | Nitromed, Inc. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025776-A1 | NITROSATED AND NITROSYLATED NONSTEROIDAL ANTIINFLAMMATORY COMPOUNDS, COMPOSITIONS AND METHODS OF USE | NITROMED, INC. (US) | 2000-05-11 | — | — | WO | disclosed |