Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 4/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.40 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 6/20 | 0.30 |
| ▸ | PPARD | Q03181 | 6/20 | 0.30 |
| ▸ | PPARA | Q07869 | 6/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.30 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7552128 | 0.92 | CES1 (0.39) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL3923583 | 0.91 | FFAR3 (0.37) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL19357539 | 0.91 | FFAR3 (0.37) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL7546476 | 0.87 | CES1 (0.41) | CES2CES1TSHRALDH1A1KMT2A | |
| SCHEMBL1074448 | 0.85 | AKR1B1 (0.46) | CES2CES1TSHRALDH1A1KMT2A | |
| SCHEMBL7544283 | 0.85 | FFAR3 (0.32) | HDAC3HDAC1HDAC2HDAC8FFAR3 | |
| SCHEMBL7542632 | 0.84 | AKR1B1 (0.45) | CES2CES1TSHRALDH1A1KMT2A | |
| SCHEMBL31625063 | 0.84 | KMT2A (0.48) | CES2CES1TSHRALDH1A1KMT2A | |
| SCHEMBL11910004 | 0.84 | KMT2A (0.48) | CES2CES1TSHRALDH1A1KMT2A | |
| SCHEMBL7542466 | 0.82 | KMT2A (0.47) | CES2CES1TSHRALDH1A1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5734061-A | Process for preparing spirocyclic lactams | SMITHKLINE BEECHAM CORPORATION (US) | 1998-03-31 | — | — | US | disclosed |