Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 2/20 | 0.49 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8562828 | 0.92 | AVPR2 (0.49) | AVPR2AVPR1ANPC1RAB9AHPGD | |
| SCHEMBL8562633 | 0.89 | AVPR2 (0.55) | AVPR2AVPR1ANPC1RAB9AHPGD | |
| SCHEMBL9236961 | 0.84 | AVPR2 (0.66) | AVPR2AVPR1A | |
| SCHEMBL8563072 | 0.84 | SMN1; SMN2 (0.55) | AVPR2AVPR1ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8558733 | 0.81 | AVPR2 (0.65) | AVPR2AVPR1A | |
| SCHEMBL8561645 | 0.81 | AVPR2 (0.58) | AVPR2AVPR1ANPC1RAB9ATAS1R3 | |
| SCHEMBL8557607 | 0.80 | NPC1 (0.50) | AVPR2AVPR1ANPC1RAB9ATAS1R3 | |
| SCHEMBL8556252 | 0.80 | NAMPT (0.63) | AVPR2AVPR1ANPC1RAB9AHPGD | |
| SCHEMBL8558857 | 0.80 | HPGD (0.57) | NPC1RAB9AHPGDSMN1; SMN2KMT2A | |
| SCHEMBL8559546 | 0.79 | AVPR2 (0.55) | AVPR2AVPR1AKMT2AALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |