Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7593171 | 0.84 | NOTUM (0.57) | PKMNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7993369 | 0.84 | DRD2 (0.54) | PKMNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL30681441 | 0.79 | DRD2 (0.53) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 | |
| SCHEMBL7554164 | 0.79 | DRD2 (0.53) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 | |
| SCHEMBL4289075 | 0.79 | DRD2 (0.53) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 | |
| SCHEMBL30681525 | 0.77 | NOTUM (0.48) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 | |
| SCHEMBL28240256 | 0.77 | MTNR1A (0.48) | PKMACE | |
| SCHEMBL4285459 | 0.76 | NOTUM (0.42) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 | |
| SCHEMBL14229140 | 0.76 | NOTUM (0.50) | PKMNOTUMALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL4386325 | 0.74 | NOTUM (0.44) | NOTUMALDH1A1CYP1A2NPC1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1833789-A1 | PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED INDOLINE-2-CARBOXYLIC ACID | DSMIP Assets B.V. (NL) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006069799-A1 | PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED INDOLINE-2-CARBOXYLIC ACID | DSM IP ASSETS B.V. (NL) | 2006-07-06 | — | — | WO | disclosed |
| US-6121460-A | Process for the preparation of an optically active indoline-2-carboxylic acid or derivative thereof | DSM N.V. (NL) | 2000-09-19 | — | — | US | disclosed |