Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | ADH1B | P00325 | 3/20 | 0.42 |
| ▸ | ADH1A | P07327 | 3/20 | 0.42 |
| ▸ | ADH7 | P40394 | 3/20 | 0.42 |
| ▸ | ADH1C | P00326 | 2/20 | 0.42 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5965957 | 0.81 | TAAR1 (0.47) | TAAR1ADH1BADH1AADH7ADH1C | |
| SCHEMBL16369385 | 0.80 | TAAR1 (0.50) | TAAR1KCNN4ALDH1A1HTTKDM4E | |
| SCHEMBL1834441 | 0.79 | TAAR1 (0.48) | TAAR1ADH1BADH1AADH7ADH1C | |
| SCHEMBL28434959 | 0.75 | CYP2C19 (0.44) | TAAR1CYP2C19HIF1AHDAC3HDAC4 | |
| SCHEMBL3368788 | 0.75 | TAAR1 (0.64) | TAAR1KCNN4CYP2C19HIF1AALDH1A1 | |
| SCHEMBL24303418 | 0.75 | TAAR1 (0.48) | TAAR1KCNN4CYP2C19HIF1AALDH1A1 | |
| SCHEMBL29078982 | 0.74 | ADH1B (0.47) | ADH1BADH1AADH7ADH1CCYP2C19 | |
| SCHEMBL9852888 | 0.73 | ADH1B (0.45) | TAAR1ADH1BADH1AADH7ADH1C | |
| SCHEMBL6751138 | 0.72 | KIF11 (0.55) | ADH1BADH1AADH7ADH1CKCNN4 | |
| SCHEMBL7832303 | 0.71 | CCR1 (0.37) | ADH1BADH1AADH7ADH1CHIF1A |
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-1542723-A4 | CROSS-LINKERS WITH HIGH REACTIVITY AND SOLUBILITY AND THEIR USE IN THE PREPARATION OF CONJUGATES FOR TARGETED DELIVERY OF SMALL MOLECULE DRUGS | IMMUNOGEN INC (US) | 2009-02-11 | — | — | EP | disclosed |
| EP-1542723-A2 | CROSS-LINKERS WITH HIGH REACTIVITY AND SOLUBILITY AND THEIR USE IN THE PREPARATION OF CONJUGATES FOR TARGETED DELIVERY OF SMALL MOLECULE DRUGS | Immunogen, Inc. (US) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004016801-A2 | CROSS-LINKERS WITH HIGH REACTIVITY AND SOLUBILITY AND THEIR USE IN THE PREPARATION OF CONJUGATES FOR TARGETED DELIVERY OF SMALL MOLECULE DRUGS | IMMUNOGEN, INC. (US) | 2004-02-26 | — | — | WO | disclosed |