Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL15988605 | 0.90 | HPGD (0.55) | HPGDRECQLALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL28753025 | 0.88 | MAPT (0.60) | ALDH1A1SMN1; SMN2MAPTNPSR1MAPK1 | |
| SCHEMBL19805597 | 0.88 | MAPT (0.60) | ALDH1A1SMN1; SMN2MAPTNPSR1MAPK1 | |
| SCHEMBL23466751 | 0.84 | RAB9A (0.60) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| SCHEMBL23466750 | 0.84 | RAB9A (0.60) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| Hydrochloric Acid SCHEMBL29758042 | 0.83 | RAB9A (0.59) | ALDH1A1SMN1; SMN2MAPTPOLBNPC1 | |
| SCHEMBL15962086 | 0.81 | HPGD (0.60) | HPGDRECQLALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL16066310 | 0.80 | LMNA (0.60) | HPGDRECQLALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL2995178 | 0.80 | SLC7A5 (0.56) | NPC1RAB9ACYP3A4CYP2C9CYP2C19 | |
| SCHEMBL2995175 | 0.80 | SLC7A5 (0.56) | NPC1RAB9ACYP3A4CYP2C9CYP2C19 |
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-2152664-A1 | DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS | Brystol-Myers Squibb Company (US) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008157162-A1 | DIPEPTIDE ANALOGS AS COAGULATION FACTOR INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-12-24 | — | — | WO | disclosed |