Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 6/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10901553 | 0.83 | TDP1 (0.36) | TDP1ALDH1A1HTR2AHTR2CHTR2B | |
| SCHEMBL10901668 | 0.79 | MAPT (0.41) | ALDH1A1HTR2AHTR2CHTR2BMAPK1 | |
| SCHEMBL1615172 | 0.77 | DRD2 (0.35) | — | |
| SCHEMBL9282832 | 0.76 | GPR35 (0.42) | TDP1ALDH1A1TSHRCYP3A4ALOX15 | |
| SCHEMBL3014685 | 0.74 | — | — | |
| SCHEMBL11903157 | 0.72 | — | — | |
| SCHEMBL8133797 | 0.72 | TDP1 (0.35) | TDP1ALDH1A1HTR2AHTR2CHTR2B | |
| SCHEMBL8080081 | 0.72 | KDM4E (0.37) | TDP1ALDH1A1TSHRHPGDCYP3A4 | |
| SCHEMBL8091818 | 0.71 | — | — | |
| SCHEMBL151908 | 0.71 | ADRA2A (0.36) | TSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-4582851-A | MICROBIOCIDES;LEUKEMIA;ANTITUMOR AND ANTICARCINOGENIC AGENTS | WARNER-LAMBERT COMPANY (US) | 1986-04-15 | — | — | US | disclosed |