Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ELOVL6 | Q9H5J4 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8666883 | 1.00 | AGTR2 (0.34) | AGTR2GRIN1GRIN2BRIPK1KMT2A | |
| SCHEMBL8671973 | 0.80 | NR1H2 (0.35) | KMT2AFFAR2 | |
| SCHEMBL8672023 | 0.76 | LMNA (0.33) | ALDH1A1KDM4EHPGDPKM | |
| SCHEMBL8668993 | 0.74 | TSHR (0.44) | KMT2AALDH1A1HPGD | |
| SCHEMBL8667689 | 0.74 | GPR88 (0.35) | AGTR2RIPK1KMT2AHTR2CFFAR2 | |
| SCHEMBL8668716 | 0.73 | FKBP1A (0.39) | KMT2ANPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL8672106 | 0.72 | LMNA (0.37) | KMT2AFFAR2ALDH1A1 | |
| SCHEMBL8688927 | 0.71 | TCF4 (0.40) | KMT2ARAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL8668725 | 0.71 | MEN1 (0.34) | KMT2AFFAR2ALDH1A1KDM1A | |
| SCHEMBL8670446 | 0.71 | CYP3A4 (0.31) | — |
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-5707991-A | TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE | RHONE-POULENC RORER S.A. (FR) | 1998-01-13 | — | — | US | disclosed |