Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.34 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.34 |
| ▸ | SSTR1 | P30872 | 2/20 | 0.34 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27659695 | 0.83 | AGTR2 (0.44) | CHRM3KMT2ATEAD3ALDH1A1SIGMAR1 | |
| SCHEMBL15845815 | 0.83 | KDM4E (0.51) | PKMKDM4E | |
| SCHEMBL28772120 | 0.82 | GPR119 (0.39) | CHRM3RIPK1 | |
| SCHEMBL15845586 | 0.81 | TEAD1 (0.44) | FAAHCHRM3ATMMAPTRAB9A | |
| SCHEMBL15845807 | 0.80 | CARM1 (0.44) | CARM1PRMT6CHRM3ATMSSTR1 | |
| SCHEMBL28215196 | 0.78 | CARM1 (0.43) | FAAHCARM1PRMT6CHRM3ATM | |
| SCHEMBL28227977 | 0.76 | LMNA (0.46) | CARM1PRMT6CHRM3RAB9APKM | |
| SCHEMBL27897795 | 0.76 | ADAM17 (0.34) | FAAH | |
| SCHEMBL27719651 | 0.74 | ALDH1A1 (0.39) | RAB9AALDH1A1KDM4ESIGMAR1 | |
| SCHEMBL15845660 | 0.74 | ATM (0.43) | FAAHCARM1PRMT6ATMALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104903300-A | Comt inhibitors | HOFFMANN LA ROCHE | 2015-09-09 | — | — | CN | disclosed |