Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | ERN1 | O75460 | 3/20 | 0.46 |
| ▸ | TLR2 | O60603 | 1/20 | 0.45 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| 2-Methoxybenzaldehyde SCHEMBL7528761 | 0.91 | MAPT (0.57) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL29708058 | 0.91 | MAPT (0.68) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL1002660 | 0.91 | MAPT (0.68) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL28289589 | 0.84 | ERN1 (0.50) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL11670985 | 0.81 | KDM4E (0.56) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL11670988 | 0.81 | KDM4E (0.56) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL30828500 | 0.78 | MAPT (0.53) | MAPTCYP1A2CYP2C9CYP2C19KDM4E | |
| SCHEMBL35849993 | 0.78 | MEN1 (0.57) | TDP1MTNR1AMTNR1BERN1MEN1 | |
| SCHEMBL9005 | 0.78 | MEN1 (0.57) | TDP1MTNR1AMTNR1BERN1MEN1 | |
| SCHEMBL11593086 | 0.78 | ERN1 (0.51) | MAPTCYP1A2CYP2C9CYP2C19HPGD |
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-1998008813-A1 | COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED PYRROLIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |