Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 8/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL7815551 | 0.86 | HRH3 (0.43) | ELANENPC1KCNH2HRH3 | |
| SCHEMBL5369563 | 0.85 | ELANE (0.42) | ELANENPC1 | |
| SCHEMBL4932747 | 0.84 | ELANE (0.43) | ELANENPC1TSHRHSD17B10MEN1 | |
| SCHEMBL7827132 | 0.82 | HDAC1 (0.37) | ELANENPC1KCNH2HRH3TSHR | |
| SCHEMBL7823078 | 0.79 | PARP1 (0.38) | NPC1TSHRMEN1KMT2A | |
| SCHEMBL7822854 | 0.78 | NPC1 (0.42) | NPC1TSHRMEN1KMT2A | |
| SCHEMBL23209066 | 0.77 | AKR1B10 (0.34) | NPC1HSD17B10MEN1KMT2A | |
| SCHEMBL29970272 | 0.77 | AKR1B10 (0.34) | NPC1HSD17B10MEN1KMT2A | |
| SCHEMBL1542331 | 0.73 | NPC1 (0.36) | ELANENPC1KMT2A | |
| SCHEMBL29991937 | 0.72 | ATM (0.47) | NPC1HSD17B10MEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0637300-B1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMA (US) | 2001-09-05 | — | — | EP | disclosed |
| US-5885996-A | AN ENZYME INHIBITORS OF THYMIDYLATE SYNTHASE WORKS AS BACTERICIDES, FUNGICIDES INHIBITING YEASTS, FUNGI | AGOURON PHARMACEUTICALS, INC. (US) | 1999-03-23 | — | — | US | disclosed |
| US-5707992-A | MICROBIOCIDES, ANTITUMOR AGENTS | AGOURON PHARMACEUTICALS, INC. (US) | 1998-01-13 | — | — | US | disclosed |
| US-5430148-A | Antiproliferative quinazolines | AGOURON PHARMACEUTICALS, INC. (US) | 1995-07-04 | — | — | US | disclosed |
| EP-0637300-A1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMACEUTICALS, INC. (US) | 1995-02-08 | — | — | EP | disclosed |
| WO-1993020055-A1 | ANTIPROLIFERATIVE QUINAZOLINES | AGOURON PHARMACEUTICALS, INC. (US) | 1993-10-14 | — | — | WO | disclosed |