Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MGMT | P16455 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.32 |
| ▸ | HPD | P32754 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27971529 | 0.98 | MAPT (0.40) | MAPTALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL15326769 | 0.87 | ALDH1A1 (0.41) | MAPTALDH1A1HPGDPOLBTDP1 | |
| SCHEMBL27971530 | 0.86 | ALDH1A1 (0.41) | MAPTALDH1A1HPGDPOLBTDP1 | |
| SCHEMBL27971678 | 0.79 | MAOB (0.35) | MAPTPOLBMAOBTDP1LMNA | |
| SCHEMBL27940470 | 0.74 | DHODH (0.44) | MAPTHPGDPOLBMAOBTDP1 | |
| SCHEMBL27921796 | 0.73 | MAOA (0.36) | POLBMAOBMAOAMGMTPTGES | |
| SCHEMBL15326750 | 0.72 | MAOB (0.36) | MAPTMEN1KMT2APOLBMAOB | |
| SCHEMBL27921772 | 0.69 | HPD (0.33) | MAPTMEN1KMT2AMAOBTDP1 | |
| SCHEMBL629645 | 0.68 | POLB (0.42) | MAPTMEN1KMT2APOLBMAOB | |
| SCHEMBL8044749 | 0.68 | PIN1 (0.44) | MAPTMEN1KMT2APOLBMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013152683-A1 | BICYCLE SUBSTITUTED PYRAZOLONEAZO DERIVATIVES AND PREPARATION METHOD AND USE THEREOF | 齐鲁制药有限公司 (CN) | 2013-10-17 | — | — | WO | disclosed |