Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 2/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
| ▸ | ESRRG | P62508 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| SCHEMBL14347383 | 0.81 | PDCD1 (0.42) | TSHRGAAALDH1A1MAPTHSD17B10 | |
| SCHEMBL14347342 | 0.81 | MEN1 (0.44) | TSHRGAAALDH1A1MAPTTDP1 | |
| SCHEMBL14347526 | 0.81 | TSHR (0.45) | TSHRALDH1A1MAPTHSD17B10TDP1 | |
| SCHEMBL14347320 | 0.80 | MAPK1 (0.41) | TSHRGAAALDH1A1MAPTHSD17B10 | |
| SCHEMBL14347338 | 0.78 | ALDH1A1 (0.45) | TSHRALDH1A1MAPTPOLBLMNA | |
| SCHEMBL14347350 | 0.77 | SMN1; SMN2 (0.42) | TDP1SMN1; SMN2LMNARAB9A | |
| SCHEMBL11630477 | 0.74 | TSHR (0.50) | TSHRGAAALDH1A1MAPTHSD17B10 | |
| SCHEMBL14347486 | 0.74 | CHRM3 (0.39) | GAAMAPTELANESMN1; SMN2LMNA | |
| SCHEMBL25890327 | 0.73 | GAA (0.44) | TSHRGAASRCALDH1A1MAPT | |
| SCHEMBL15820754 | 0.73 | ALDH1A1 (0.47) | TSHRGAAALDH1A1MAPTPOLB |
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-7312211-B2 | Pryanone compounds useful as reversible inhibitors of cysteine proteases | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2007-12-25 | — | — | US | disclosed |