Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT1 | P30419 | 2/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.39 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4965593 | 0.98 | NMT1 (0.44) | NMT1HSD11B1HSD17B1HSD17B2KMT2A | |
| SCHEMBL4963210 | 0.92 | TRPV4 (0.40) | NMT1HSD11B1HSD17B1HSD17B2KMT2A | |
| SCHEMBL4966468 | 0.90 | TRPV4 (0.39) | NMT1HSD11B1HSD17B1HSD17B2KMT2A | |
| SCHEMBL4965636 | 0.83 | HSD11B1 (0.43) | NMT1HSD11B1HSD17B1HSD17B2KMT2A | |
| SCHEMBL4962705 | 0.83 | HSD11B1 (0.42) | NMT1HSD11B1HSD17B1HSD17B2KMT2A | |
| SCHEMBL4964132 | 0.81 | ROCK1 (0.42) | TRPV4SIGMAR1LMNATSHRALDH1A1 | |
| SCHEMBL4962582 | 0.81 | HSD11B1 (0.41) | HSD11B1KMT2ATRPV4ALDH1A1PDK1 | |
| SCHEMBL4965583 | 0.79 | NPC1 (0.43) | HSD11B1KMT2ATRPV4MEN1ALDH1A1 | |
| SCHEMBL4965266 | 0.78 | HSD11B1 (0.44) | HSD11B1KMT2ATRPV4SIGMAR1LMNA | |
| SCHEMBL4962933 | 0.78 | KMO (0.43) | HSD11B1KMT2AALDH1A1PDK1PDK2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1888544-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | Takeda San Diego, Inc. (US) | 2008-02-20 | — | — | EP | claimed |
| WO-2006066109-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2006-06-22 | — | — | WO | claimed |
| EP-1888544-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | Takeda San Diego, Inc. (US) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006066109-A2 | HYDROXYSTEROID DEHYDROGENASE INHIBITORS | TAKEDA SAN DIEGO, INC. (US) | 2006-06-22 | — | — | WO | disclosed |