Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL27926949 | 0.80 | TDP1 (0.50) | TDP1GAAALDH1A1KDM4EKMT2A | |
| SCHEMBL11469832 | 0.78 | KDM4E (0.80) | TDP1ALDH1A1KDM4EKMT2AL3MBTL1 | |
| SCHEMBL11469833 | 0.78 | KDM4E (0.80) | TDP1ALDH1A1KDM4EKMT2AL3MBTL1 | |
| SCHEMBL6931605 | 0.75 | HTR3A (0.49) | ALDH1A1KDM4EKMT2AHPGDSMN1; SMN2 | |
| SCHEMBL29253491 | 0.75 | ADRB1 (0.46) | ALDH1A1KDM4EKMT2AHPGDSMN1; SMN2 | |
| SCHEMBL6933869 | 0.75 | GAA (0.50) | GAAALDH1A1KDM4EKMT2ASMN1; SMN2 | |
| SCHEMBL4871242 | 0.75 | PTGS1 (0.42) | TDP1GAAALDH1A1KDM4EKMT2A | |
| SCHEMBL6933020 | 0.74 | ADRB1 (0.47) | TDP1L3MBTL1PTGS1PTGS2SMN1; SMN2 | |
| SCHEMBL6932180 | 0.73 | SIGMAR1 (0.47) | ALDH1A1KMT2AHPGDALOX15SMN1; SMN2 | |
| SCHEMBL6934619 | 0.72 | CYP1A2 (0.46) | TDP1ALDH1A1KDM4EKMT2APTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1366030-A2 | MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS | Neurogen Corporation (US) | 2003-12-03 | — | — | EP | claimed |
| WO-2002004433-A2 | MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 2002-01-17 | — | — | WO | claimed |