Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 5/20 | 0.37 |
| ▸ | PRKDC | P78527 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.33 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TLR2 | O60603 | 1/20 | 0.32 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.32 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3941671 | 0.91 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL3946740 | 0.91 | ALDH1A1 (0.41) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL5746990 | 0.88 | ALDH1A1 (0.37) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL5746992 | 0.82 | PDE4B (0.37) | ALDH1A1ACACBMAPTPDE4BALOX15 | |
| SCHEMBL5225656 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL6205811 | 0.81 | ACACB (0.36) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL5746874 | 0.76 | ALDH1A1 (0.47) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL15895661 | 0.74 | ALDH1A1 (0.49) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL17765451 | 0.72 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4ETDP1ERN1 | |
| SCHEMBL29752019 | 0.72 | ALDH1A1 (0.68) | ALDH1A1TSHRKDM4ETDP1ERN1 |
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-1613635-A2 | SOLID PHASE SYNTHESIS OF ANTITUMORAL COMPOUNDS | PHARMA MAR, S.A. (ES) | 2006-01-11 | — | — | EP | disclosed |
| WO-2004073598-A2 | SOLID PHASE SYNTHESIS OF ANTITUMORAL COMPOUNDS | PHARMA MAR, S.A.U. (ES) | 2004-09-02 | — | — | WO | disclosed |