Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11046716 | 0.90 | NLRP3 (0.44) | NLRP3ALDH1A1KDM4EKMT2ACYP1A2 | |
| SCHEMBL11546072 | 0.88 | HPGD (0.57) | NLRP3ALDH1A1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL11545759 | 0.84 | SMN1; SMN2 (0.41) | NLRP3ALDH1A1KDM4EKMT2ASMN1; SMN2 | |
| SCHEMBL11546331 | 0.83 | HPGD (0.43) | NLRP3ALDH1A1KDM4EKMT2ACYP1A2 | |
| SCHEMBL11546525 | 0.83 | NLRP3 (0.49) | NLRP3ALDH1A1KDM4EKMT2ACYP1A2 | |
| SCHEMBL14489629 | 0.81 | KDM4E (0.50) | NLRP3ALDH1A1KDM4EKMT2ACYP1A2 | |
| SCHEMBL11548757 | 0.80 | BACE1 (0.56) | ALDH1A1KMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11547093 | 0.77 | HPGD (0.48) | KDM4EKMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL14483897 | 0.77 | KDM4E (0.50) | ALDH1A1KDM4EKMT2ACYP1A2SMN1; SMN2 | |
| SCHEMBL11035760 | 0.77 | NLRP3 (0.48) | NLRP3ALDH1A1KDM4EKMT2ACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4145363-A | ANTIASTHMATICS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1979-03-20 | — | — | US | disclosed |
| US-4063025-A | PROPHYLAXIS, ANTIASTHMATIC | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) | 1977-12-13 | — | — | US | disclosed |