Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | GAA | P10253 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9314350 | 0.81 | KMT2A (0.36) | KMT2AGAAMAPTTDP1THRB | |
| SCHEMBL5916047 | 0.75 | — | — | |
| SCHEMBL4138938 | 0.67 | KMT2A (0.56) | KMT2AGAAMAPTMEN1ESR1 | |
| SCHEMBL4132466 | 0.64 | KMT2A (0.49) | KMT2AGAAMAPTMEN1ESR1 | |
| SCHEMBL4120837 | 0.64 | LMNA (0.56) | KMT2AGAAMAPTMEN1ESR1 | |
| SCHEMBL9314631 | 0.63 | ALDH1A1 (0.34) | KMT2AGAAMAPTMEN1ESR1 | |
| SCHEMBL27585204 | 0.63 | ACHE (0.32) | TDP1 | |
| SCHEMBL27714863 | 0.62 | KMT2A (0.44) | KMT2AGAAMAPTTDP1MEN1 | |
| SCHEMBL7819486 | 0.62 | KMT2A (0.39) | KMT2AGAAMAPTTDP1THRB | |
| SCHEMBL7817471 | 0.62 | KMT2A (0.39) | KMT2AGAAMAPTTDP1MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5306600-A | Oxygen-containing titanocenes, and the use thereof | CIBA-GEIGY CORPORATION (US) | 1994-04-26 | — | — | US | disclosed |
| US-5232929-A | 3-aminopiperidine derivatives and related nitrogen containing heterocycles and pharmaceutical compositions and use | PFIZER INC. (US) | 1993-08-03 | — | — | US | disclosed |
| US-5192642-A | Photoinitiators for addition photopolymerization, coatings | CIBA-GEIGY CORPORATION (US) | 1993-03-09 | — | — | US | disclosed |