Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | GFER | P55789 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | CPA1 | P15085 | 2/20 | 0.43 |
| ▸ | CPB1 | P15086 | 1/20 | 0.43 |
| ▸ | CPA3 | P15088 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9736631 | 0.93 | CPA1 (0.51) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| SCHEMBL8973462 | 0.77 | KMT2A (0.56) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| SCHEMBL10894262 | 0.76 | KMT2A (0.55) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| Ammonia Solution, Strong SCHEMBL10867243 | 0.76 | KMT2A (0.55) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| Ammonia Solution, Strong SCHEMBL10890190 | 0.76 | KMT2A (0.55) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| SCHEMBL11199413 | 0.75 | HPGD (1.00) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| Dimethylamine SCHEMBL10893716 | 0.75 | ALDH1A1 (0.54) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| Dimethylamine SCHEMBL10893710 | 0.75 | ALDH1A1 (0.54) | HPGDCYP1A2CYP2C9CYP2C19GFER | |
| SCHEMBL5020552 | 0.75 | DDAH1 (0.71) | HPGDRAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL9734833 | 0.74 | HPGD (0.55) | HPGDCYP1A2CYP2C9CYP2C19GFER |
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-5152929-A | Corrosion inhibitors for water systems | CIBA-GEIGY CORPORATION (US) | 1992-10-06 | — | — | US | disclosed |