Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.42 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10916891 | 1.00 | AMY1A (0.48) | AMY1APTPN1DPP4KDM4ELMNA | |
| SCHEMBL10913844 | 0.83 | CA12 (0.54) | KDM4ECYP1A2MEN1KMT2ACA12 | |
| SCHEMBL10913846 | 0.83 | CA12 (0.54) | KDM4ECYP1A2MEN1KMT2ACA12 | |
| SCHEMBL10916104 | 0.83 | KDM4E (0.53) | AMY1APTPN1DPP4KDM4ELMNA | |
| SCHEMBL1832812 | 0.76 | CA12 (0.60) | LMNASCN2ACA12CA9CA1 | |
| SCHEMBL28835623 | 0.74 | GSK3B (0.64) | AMY1APTPN1DPP4KDM4ELMNA | |
| SCHEMBL29531485 | 0.74 | CA1 (0.62) | KDM4ESCN2ACA12CA9CA1 | |
| SCHEMBL17550101 | 0.74 | CA1 (0.62) | KDM4ESCN2ACA12CA9CA1 | |
| SCHEMBL10916926 | 0.73 | CYP2C19 (0.58) | CYP1A2CYP2C19MEN1KMT2AALDH1A1 | |
| SCHEMBL10916929 | 0.73 | CYP2C19 (0.58) | CYP1A2CYP2C19MEN1KMT2AALDH1A1 |
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-0055562-B1 | CEPHALOSPORIN DERIVATIVES | ICI PHARMA (FR) | 1986-02-12 | — | — | EP | disclosed |
| US-4492692-A | BACTERICIDE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-01-08 | — | — | US | disclosed |