Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | HTR4 | Q13639 | 5/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.40 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.38 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.38 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CPN1 | P15169 | 1/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4018664 | 1.00 | ALOX15 (0.50) | ALOX15TSHREPHX1EPHX2HTR4 | |
| Hydrochloric Acid SCHEMBL4012895 | 0.98 | ALOX15 (0.49) | ALOX15TSHREPHX1EPHX2HTR4 | |
| Hydrochloric Acid SCHEMBL4012890 | 0.98 | ALOX15 (0.49) | ALOX15TSHREPHX1EPHX2HTR4 | |
| SCHEMBL10446115 | 0.84 | ALOX15 (0.54) | ALOX15TSHREPHX1EPHX2HTR4 | |
| Hydrochloric Acid SCHEMBL28212506 | 0.79 | ALOX15 (0.49) | ALOX15TSHREPHX1EPHX2HTR4 | |
| SCHEMBL3633232 | 0.76 | ALOX15 (0.47) | ALOX15TSHREPHX1EPHX2HTR4 | |
| SCHEMBL28767035 | 0.76 | EPHX2 (0.40) | EPHX1EPHX2KMT2A | |
| SCHEMBL28767036 | 0.76 | EPHX2 (0.40) | EPHX1EPHX2KMT2A | |
| SCHEMBL19975154 | 0.75 | TDP1 (0.46) | TSHREPHX1ANPEPTDP1KMT2A | |
| SCHEMBL12413661 | 0.75 | SLC6A1 (0.46) | ALOX15TSHREPHX1EPHX2HTR4 |
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-1784393-B1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2009-07-01 | — | — | EP | disclosed |
| EP-1784393-B1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2009-07-01 | — | — | EP | disclosed |