Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.38 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.38 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 2/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | ALAD | P13716 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6873159 | 0.72 | CASP3 (0.39) | ALDH1A1MAPTPOLBRAB9ACASP3 | |
| SCHEMBL6018804 | 0.71 | PLK1 (0.38) | ALDH1A1MAPTRAB9ASMN1; SMN2LMNA | |
| SCHEMBL6018664 | 0.70 | MAPK14 (0.45) | MAPTCYP1A2SMN1; SMN2NPC1KDM4E | |
| SCHEMBL5718225 | 0.70 | MAPT (0.38) | ALDH1A1MAPTRAB9ACYP1A2CYP2C9 | |
| SCHEMBL1801707 | 0.68 | PLK1 (0.43) | ALDH1A1MAPTCYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL10088515 | 0.68 | NOTUM (0.44) | ALDH1A1MAPTPOLBCYP1A2CYP2D6 | |
| SCHEMBL10493450 | 0.67 | IKBKB (0.43) | ALDH1A1MAPTPOLBRAB9ACYP1A2 | |
| SCHEMBL6255667 | 0.67 | ALDH1A1 (0.52) | ALDH1A1MAPTSMN1; SMN2KDM4EMEN1 | |
| SCHEMBL1797326 | 0.66 | KDM4E (0.55) | ALDH1A1MAPTPOLBRAB9ASMN1; SMN2 | |
| SCHEMBL4078516 | 0.66 | CES2 (0.65) | ALDH1A1MAPTRAB9ACYP1A2CYP2C9 |
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-1412347-B1 | PROCESS FOR THE PREPARATION OF HETEROCYCLIC PENTALENE DERIVATIVES | BASELL POLYOLEFINE GMBH (DE) | 2006-01-11 | — | — | EP | disclosed |
| US-6930190-B2 | Process for the preparation of heterocyclic pentalene derivatives | BASELL POLYOLEFINE GMBH (DE) | 2005-08-16 | — | — | US | disclosed |