Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 6/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | DHODH | Q02127 | 1/20 | 0.47 |
| ▸ | NPY1R | P25929 | 1/20 | 0.46 |
| ▸ | NPY2R | P49146 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11259170 | 0.88 | POLB (0.43) | SIGMAR1MAPTMEN1KMT2ADHODH | |
| SCHEMBL11405358 | 0.88 | SIGMAR1 (0.54) | SIGMAR1MAPTMEN1KMT2ADHODH | |
| SCHEMBL11578514 | 0.84 | NPC1 (0.43) | MAPTMEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL11579511 | 0.84 | MEN1 (0.56) | MEN1KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL18324579 | 0.84 | SIGMAR1 (0.59) | SIGMAR1MAPTMEN1KMT2ADHODH | |
| SCHEMBL11252261 | 0.84 | MAPK1 (0.48) | MAPTMEN1KMT2ANPY1RNPY2R | |
| SCHEMBL6719185 | 0.84 | SIGMAR1 (0.56) | SIGMAR1MAPTMEN1KMT2ADHODH | |
| SCHEMBL11581488 | 0.82 | MAPT (0.38) | MAPTALDH1A1NPC1RAB9AHPGD | |
| SCHEMBL11266958 | 0.82 | MAPK1 (0.51) | MAPTMEN1KMT2AALDH1A1NPC1 | |
| SCHEMBL11254202 | 0.82 | ALDH1A1 (0.46) | SIGMAR1MAPTMEN1KMT2AALDH1A1 |
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-4326074-A | ANTIDIARRHEA AGENTS | WILLIAM H. RORER, INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4115564-A | Treatment of diarrhea with amidinoureas | WILLIAM H. RORER, INC. (US) | 1978-09-19 | — | — | US | disclosed |
| US-4088785-A | HYPOTENSIVE AGENTS | WILLIAM H. RORER, INC. (US) | 1978-05-09 | — | — | US | disclosed |