Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TACR1 | P25103 | 2/20 | 0.48 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MPO | P05164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9234332 | 1.00 | PKM (0.49) | PKMTACR1SSTR1KDM4EMAPT | |
| SCHEMBL9112564 | 0.82 | CTSL (0.54) | PKMTACR1KDM4EMAPTMEN1 | |
| SCHEMBL9110935 | 0.81 | PKM (0.48) | PKMTACR1KDM4EMAPTMEN1 | |
| SCHEMBL1929179 | 0.78 | SSTR1 (0.61) | TACR1SSTR1KDM4EMAPTMEN1 | |
| SCHEMBL1929176 | 0.78 | SSTR1 (0.61) | TACR1SSTR1KDM4EMAPTMEN1 | |
| SCHEMBL1929174 | 0.78 | SSTR1 (0.61) | TACR1SSTR1KDM4EMAPTMEN1 | |
| SCHEMBL9113627 | 0.77 | MMP2 (0.40) | TACR1MAPT | |
| SCHEMBL9112328 | 0.77 | — | — | |
| SCHEMBL133958 | 0.75 | TACR1 (0.72) | PKMTACR1KDM4EMAPTMEN1 | |
| SCHEMBL839065 | 0.75 | TACR1 (0.72) | PKMTACR1KDM4EMAPTMEN1 |
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-1995008550-A1 | ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1995-03-30 | — | — | WO | disclosed |