Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.57 |
| ▸ | HTT | P42858 | 4/20 | 0.57 |
| ▸ | RECQL | P46063 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9873976 | 0.88 | CYP2J2 (0.48) | NPSR1HTTRECQLALDH1A1ATM | |
| SCHEMBL9874649 | 0.85 | CYP2J2 (0.54) | CYP2C9MEN1KMT2AHRH1 | |
| SCHEMBL9874017 | 0.84 | CYP2J2 (0.51) | CYP2C9LMNAHRH1 | |
| SCHEMBL9871849 | 0.83 | NPSR1 (0.51) | NPSR1HTTRECQLSMN1; SMN2CYP2D6 | |
| Water SCHEMBL9873813 | 0.83 | NPSR1 (0.54) | NPSR1HTTRECQLSMN1; SMN2CYP2D6 | |
| Water SCHEMBL9873819 | 0.83 | NPSR1 (0.54) | NPSR1HTTRECQLSMN1; SMN2CYP2D6 | |
| SCHEMBL9874149 | 0.82 | CYP2J2 (0.61) | CYP2C9LMNAHRH1 | |
| SCHEMBL9871858 | 0.81 | CYP2J2 (0.58) | CYP2C9LMNAHRH1 | |
| SCHEMBL9786980 | 0.81 | HRH1 (0.44) | DNMT1EHMT2HRH1 | |
| SCHEMBL9786838 | 0.80 | HTT (0.46) | NPSR1HTTRECQLSMN1; SMN2CYP2D6 |
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-5057524-A | Asthma, dermatitis | A. H. ROBINS COMPANY INCORPORATED (US) | 1991-10-15 | — | — | US | disclosed |