Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TTR | P02766 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11659849 | 0.89 | AKR1B1 (0.49) | AKR1B1MAPK14MTNR1AMTNR1BNPC1 | |
| SCHEMBL11567084 | 0.83 | AKR1B1 (0.54) | AKR1B1MAPK14MTNR1AMTNR1BKMT2A | |
| SCHEMBL2007673 | 0.82 | AKR1B1 (0.57) | AKR1B1MAPK14SMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL11564650 | 0.81 | CA12 (0.40) | AKR1B1MTNR1AMTNR1BKMT2ACA12 | |
| SCHEMBL11566471 | 0.79 | AKR1B1 (0.60) | AKR1B1MAPK14MAPTALDH1A1TTR | |
| SCHEMBL11567792 | 0.79 | AKR1B1 (0.52) | AKR1B1MAPK14KMT2AMAPTALDH1A1 | |
| SCHEMBL11568284 | 0.78 | AKR1B1 (0.38) | AKR1B1KMT2ANPC1RAB9AMAPT | |
| SCHEMBL11659196 | 0.78 | AKR1B1 (0.53) | AKR1B1MAPK14KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL11663201 | 0.78 | AKR1B1 (0.61) | AKR1B1MAPK14KMT2ANPC1RAB9A | |
| SCHEMBL11562156 | 0.78 | AKR1B1 (0.65) | AKR1B1MAPK14RAB9ASMN1; SMN2ALDH1A1 |
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-0003422-A1 | Novel 4-(8X-6,11-dihydrodibenzo-(b,e)-thiepin-11-one-3-yl)-4-oxobutyric acids, methods of preparation, compositions and uses thereof | SYNTEX (U.S.A.) INC. (US) | 1979-08-08 | — | — | EP | disclosed |
| US-4130654-A | ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, FRIBRINOLYTIC, MUSCLE RELAXANT | SYNTEX (U.S.A.) INC. (US) | 1978-12-19 | — | — | US | disclosed |