Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17266326 | 0.86 | TSHR (0.49) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL12836125 | 0.82 | CYP3A4 (0.47) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL476473 | 0.81 | CYP1A2 (0.46) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL8392046 | 0.81 | CYP1A2 (0.50) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL29137043 | 0.81 | SMN1; SMN2 (0.44) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL8392970 | 0.81 | CYP1A2 (0.50) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL8397236 | 0.80 | CYP1A2 (0.53) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL16561481 | 0.79 | CYP3A4 (0.45) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL13512389 | 0.76 | TSHR (0.46) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 | |
| SCHEMBL2093049 | 0.76 | TSHR (0.46) | SMN1; SMN2MEN1GAAKMT2ACYP1A2 |
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-5925655-A | NOVEL ISOINDOLONE DERIVATIVES FOR INHIBITING BONE RESORPTION, TREATING AND PREVENTING OSTEOPOROSIS AND CANCER DIABETIC RETINOPATHY AND OTHER DISEASES | MERCK & CO., INC. (US) | 1999-07-20 | — | — | US | disclosed |