Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11263870 | 0.98 | ALOX15 (0.43) | ALOX15CYP3A4TDP1SMN1; SMN2TP53 | |
| SCHEMBL11714480 | 0.79 | ABL1 (0.50) | ALOX15CYP3A4TDP1SMN1; SMN2MAPT | |
| SCHEMBL10373446 | 0.78 | CSNK2A1 (0.52) | ALOX15TDP1SMN1; SMN2TP53MAPT | |
| SCHEMBL7001137 | 0.78 | ACHE (0.54) | CYP3A4SMN1; SMN2MAPTALDH1A1HSD17B10 | |
| SCHEMBL9770532 | 0.78 | ALOX15 (0.50) | ALOX15CYP3A4TDP1SMN1; SMN2TP53 | |
| SCHEMBL8071051 | 0.78 | TDP1 (0.50) | ALOX15CYP3A4TDP1SMN1; SMN2TP53 | |
| SCHEMBL1129416 | 0.77 | ALDH1A1 (0.64) | ALOX15CYP3A4TDP1SMN1; SMN2TP53 | |
| SCHEMBL11162396 | 0.77 | ALOX15 (0.45) | ALOX15CYP3A4TDP1SMN1; SMN2TP53 | |
| SCHEMBL27721513 | 0.77 | CPS1 (0.38) | SMN1; SMN2MAPTNPC1ALDH1A1GAA | |
| SCHEMBL4098055 | 0.74 | IDO1 (0.47) | TDP1SMN1; SMN2TP53MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4348396-A | Substituted 11-oxo-11H-pyrido[2,1-b]quinazolines and method of inhibiting allergic reactions with them | HOFFMANN-LA ROCHE INC. (US) | 1982-09-07 | — | — | US | disclosed |
| US-4282360-A | ANTIALLERGENS | HOFFMANN-LA ROCHE INC. (US) | 1981-08-04 | — | — | US | disclosed |
| EP-0027268-A2 | Quinazoline derivatives, process and intermediates for their preparation, medicaments containing them and their pharmaceutical use | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1981-04-22 | — | — | EP | disclosed |