Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | PLIN1 | O60240 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | PLIN5 | Q00G26 | 2/20 | 0.39 |
| ▸ | ABHD5 | Q8WTS1 | 2/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1322885 | 1.00 | AKT1 (0.43) | AKT1ALDH1A1TSHRTGM2LMNA | |
| SCHEMBL7858222 | 0.78 | LMNA (0.44) | ALDH1A1LMNAMAPTCYP1A2HDAC3 | |
| SCHEMBL11377387 | 0.78 | LMNA (0.44) | ALDH1A1LMNAMAPTCYP1A2HDAC3 | |
| SCHEMBL9360731 | 0.78 | LMNA (0.44) | ALDH1A1LMNAMAPTCYP1A2HDAC3 | |
| Acrylic Acid SCHEMBL6716395 | 0.75 | HDAC3 (0.43) | AKT1ALDH1A1TSHRTGM2LMNA | |
| SCHEMBL9509384 | 0.74 | AKR1C3 (0.48) | ALDH1A1TSHRLMNAMAPTCYP1A2 | |
| SCHEMBL9509381 | 0.74 | AKR1C3 (0.48) | ALDH1A1TSHRLMNAMAPTCYP1A2 | |
| SCHEMBL6249968 | 0.69 | KMT2A (0.42) | ALDH1A1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL6249973 | 0.69 | KMT2A (0.42) | ALDH1A1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL1304893 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1365805-A2 | NOVEL TARGETED COMPOSITIONS FOR DIAGNOSTIC AND THERAPEUTIC USE | Imarx Therapeutics, Inc. (US) | 2003-12-03 | — | — | EP | disclosed |
| WO-2002036161-A2 | NOVEL TARGETED COMPOSITIONS FOR DIAGNOSTIC AND THERAPEUTIC USE | IMARX THERAPEUTICS, INC. (US) | 2002-05-10 | — | — | WO | disclosed |