Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 6/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL962296 | 0.78 | LMNA (0.46) | ALDH1A1TSHRTP53PRSS1LMNA | |
| SCHEMBL11765420 | 0.73 | TSHR (0.50) | ALDH1A1CYP3A4TSHRTDP1L3MBTL1 | |
| SCHEMBL3919092 | 0.73 | KMT2A (0.43) | ALDH1A1L3MBTL1LMNAKDM4ESMN1; SMN2 | |
| SCHEMBL164400 | 0.71 | ALDH1A1 (0.42) | ALDH1A1TSHR | |
| SCHEMBL1513875 | 0.71 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CA2TSHRTDP1 | |
| SCHEMBL963718 | 0.70 | TSHR (0.34) | ALDH1A1CYP3A4TSHRTDP1LMNA | |
| SCHEMBL3918072 | 0.70 | LMNA (0.41) | ALDH1A1CYP3A4L3MBTL1MAPK1LMNA | |
| SCHEMBL11617686 | 0.69 | ALDH1A1 (0.53) | ALDH1A1CYP3A4CA2TSHRTDP1 | |
| SCHEMBL9581138 | 0.68 | ALDH1A1 (0.49) | ALDH1A1CYP3A4CA2TSHRTDP1 | |
| SCHEMBL5834586 | 0.68 | ALDH1A1 (0.68) | ALDH1A1CYP3A4CA2TSHRTDP1 |
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-5780530-A | COMPRISING POLYOL RESIN, CURING AGENT, REACTIVE ULTRAFINE SILICA PARTICLES, CATALYST | NIPPON PAINT CO., LTD. (JP) | 1998-07-14 | — | — | US | disclosed |