Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8055340 | 0.84 | CYP2D6 (0.40) | CYP2D6TSHRALDH1A1HSD17B10HPGD | |
| SCHEMBL8849619 | 0.83 | CYP2D6 (0.38) | CYP2D6TSHRALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL9347249 | 0.82 | CYP2D6 (0.37) | CYP2D6TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL7488075 | 0.81 | CYP2D6 (0.38) | CYP2D6TSHRESR2CYP3A4HSD17B2 | |
| SCHEMBL4589689 | 0.80 | CYP2D6 (0.54) | CYP2D6TSHRALDH1A1HSD17B10HPGD | |
| SCHEMBL9343298 | 0.78 | CYP2C19 (0.54) | CYP2C19SMN1; SMN2 | |
| SCHEMBL9472706 | 0.77 | CYP2D6 (0.33) | CYP2D6ALDH1A1 | |
| SCHEMBL28379813 | 0.75 | CYP2D6 (0.59) | CYP2D6TSHRALDH1A1HSD17B10HPGD | |
| SCHEMBL7499812 | 0.75 | CYP2D6 (0.32) | CYP2D6GAA | |
| SCHEMBL7498972 | 0.74 | CYP2D6 (0.32) | CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0236880-B1 | Penem derivatives | ERBA CARLO SPA (IT) | 1994-07-20 | — | — | EP | disclosed |
| US-4886793-A | PENICILLINS; HUMANS OR ANIMALS | FARMITALIA CARLO ERBA, S.R.L. (IT) | 1989-12-12 | — | — | US | disclosed |
| EP-0236880-A2 | Penem derivatives | FARMITALIA CARLO ERBA S.r.l. (IT) | 1987-09-16 | — | — | EP | disclosed |