Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | VNN1 | O95497 | 3/20 | 0.39 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.37 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | FLT4 | P35916 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.35 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | CETP | P11597 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL679186 | 0.85 | CES2 (0.47) | CES2KMT2AATMP2RX1TMPRSS4 | |
| SCHEMBL7728942 | 0.84 | CETP (0.40) | CES2KMT2AATMVNN1CETP | |
| SCHEMBL679313 | 0.83 | CES2 (0.52) | CES2VNN1DDR1GPBAR1RXRA | |
| SCHEMBL29593993 | 0.83 | CES2 (0.52) | CES2VNN1DDR1GPBAR1RXRA | |
| SCHEMBL8703955 | 0.79 | CES2 (0.41) | CES2VNN1TMPRSS4DDR1RXRA | |
| SCHEMBL30518051 | 0.75 | CES2 (0.72) | CES2KMT2ATMPRSS4FLT1FLT4 | |
| SCHEMBL9230110 | 0.75 | CES2 (0.47) | CES2KMT2AATMFLT1FLT4 | |
| SCHEMBL937022 | 0.75 | CES2 (0.72) | CES2KMT2ATMPRSS4FLT1FLT4 | |
| SCHEMBL8701942 | 0.73 | KCNQ3 (0.40) | KMT2AATMVNN1 | |
| SCHEMBL322157 | 0.73 | CES2 (0.67) | CES2P2RX1RXRARXRBRXRG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |